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The Power of Precision
Natural Products High Resolution MS/MS Spectral Library
For use with the X500R QTOF system powered by SCIEX OS
The Natural Products HR-MS/MS Library contains the high resolution MS/MS spectra in positive and negative ion mode (where appropriate) comprising more than 2,500 compounds assoicated with natural products and traditional medicines. The high resolution library is designed for library searching against high resolution product ion data generated on the TripleTOF series of instruments. The library is accessible through MasterView 1.1. This kit includes one Natural Product HR-MS/MS Spectral Library 1.0 DVD and a single one year expiring license. After the one year expiration, the license must be renewed to continue to have access to the library.
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| Compound Name |
|---|
| 2,3,5,4-四羟基二苯乙烯葡萄糖苷 2,3,5,4'-Tetrahydroxystilbene-2-O-b-D-glucoside |
| 6-羟基-7,8- 二甲氧基香豆素 6-hydroxy-7,8-dimethoxycoumarin |
| （-）-丁香树脂酚-4-O-β-D-呋喃芹糖基-（1→2）-β-D-吡喃葡萄糖苷 + HCOOH |
| （-）-丁香树脂酚-4-O-β-D-呋喃芹糖基-（1→2）-β-D-吡喃葡萄糖苷 + Na |
| （-）-丁香树脂酚-4-O-β-D-呋喃芹糖基-（1→2）-β-D-吡喃葡萄糖苷(-)-Syringaresnol-4-O-β-D-apiofuranosyl-(1→2)-β-D-glucopyran |
| (±)原苏木素B Protosappanin B |
| (6aR，11aR)-3-羟基-9，10-二甲氧基紫檀烷 3-Hydroxy-9,10-Dimethoxypterocarpan |
| (R,S)-告依春 Epigoitrin |
| 1,2,3,6,7-五甲氧基口山酮 1,2,3,6,7-Pentamethoxyxanthone |
| 1,2,3,7-四甲氧基口山酮 1,2,3,7-Tetramethoxyxanthone |
| 1,4-二咖啡酰奎宁酸 1,4-Dicaffeoylquinic Acid (Cynarin) |
| 1,5－二咖啡酰奎宁酸 1,5-Dicaffeoylquinic acid |
| 1,7-二甲氧基口山酮 1,7-Dimethoxyxanthone |
| 1,8-二羟基蒽醌 1,8-Dihydroxyanthraquinone |
| 10-姜酚 10-Gingerol |
| 10-姜酚 10-Gingerol +Na |
| 10-羟基-2-癸烯酸 10-Hydroxy-2-decenoic acid |
| 10-羟基癸烯酸 10-hydroxydec-2-enoic acid |
| 10-脱乙酰基巴卡丁Ⅲ 10-Deacetylbaccatin III +HCOOH |
| 10-脱乙酰基巴卡丁Ⅲ10-Deacetylbaccatin III +Na |
| 11-羰基-β-乙酰乳香酸 Acetyl-11-keto-β-boswellic acid |
| 1-羟基咪达唑仑 1'-Hydroxymidazolam |
| 1-脱氧野尻霉素 1-Deoxynojirimycin |
| 2’-o-乙酰基金石蚕苷 2'-O-acetylpoliumoside |
| 20(R)-人参三醇 Panaxatriol |
| 20(R)-人参二醇 Panaxadiol |
| 20(R)人参皂苷Rg3 20(R)-Ginsenoside Rg3 |
| 20(R)人参皂苷Rg3 20(R)-Ginsenoside Rg3 +HCOOH |
| 20(R)-人参皂苷Rh1 20(R)-Ginsenoside Rh1 +HCOOH |
| 20(R)-人参皂苷Rh2 20(R)-Ginsenoside Rh2 +HCOOH |
| 20(S)-人参皂苷 Rg3 20(S)-Ginsenoside Rg3 |
| 20(S)人参皂苷F1 20(S)-Ginsenoside F1 +HCOOH |
| 20(S)人参皂苷F1 20(S)-Ginsenoside F1 +Na |
| 20(S)人参皂苷Rg3 20(S)Ginsenoside Rg3 +HCOOH |
| 20(S)-原人参三醇 20(S)-Protopanaxatriol +HCOOH |
| 20(S)-原人参二醇 20(S)-Protopanaxadiol +HCOOH |
| 20S人参皂苷Rh2 20S-Ginsenoside Rh2 +HCOOH |
| 23-乙酰泽泻醇B Alisol B 23-acetate |
| 2-甲氧基肉桂酸 2-Methoxycinnamic acid |
| 3，4－二咖啡酰奎宁酸 3,4-DCQA Isochlorogenic acid B |
| 3,5-O-双咖啡酰基奎宁酸，异绿原酸A 3,5-Dicaffeoyl quinic acid |
| 3，5－二咖啡酰奎宁酸 3,5-DCQA Isochlorogenic acid A |
| 3,6`-二芥子酰基蔗糖3,6’－Disinapoyl sucrose |
| 3-O-α-L-鼠李糖-(1→2)-β-葡萄糖麦冬苷元 |
| 3-羟基巴戟醌 3-Hydroxymorindone |
| 4，5－二咖啡酰奎宁酸 4,5-DCQA Isochlorogenic acid C |
| 4'-O-甲基补骨脂查尔酮 4'-O-Methylbroussochalcone B |
| 4-β-D-葡萄糖基-1,3,7-三羟基砧吨酮 Lancerin |
| 4'-去甲基表鬼臼毒素 4'-Demethylepipodophyllotoxin |
| 4-甲基伞形酮 Hymecromone |
| 4-羟基甲苯磺丁脲 4-Hydroxytolbutamide |
| 4-羟基美芬妥因 4-Hydroxymephenytoin |
| 4-羟基香豆素 4-Hydroxycoumarin |
| 5-O-甲基维斯阿米醇苷 4'-O-β-Glucopyranosyl-5-O-methylvisamminol |
| 5-O-甲基维斯阿米醇苷 4'-O-β-Glucopyranosyl-5-O-methylvisamminol +HCOOH |
| 5-甲氧基补骨脂素 Bergapten |
| 5-羟基色氨酸 5-hydroxytryptophan |
| 5-羟甲基糠醛 5-Hydroxymethylfurfural |
| 6-去氧梓醇 6-Deoxycatalpol +HCOOH |
| 6-姜辣素 6-Gingerol |
| 6－甲基香豆素 6-Methylcoumarin |
| 6-羟基-7-甲氧基香豆素 Isoscopoletin |
| 7-乙基-10-羟基喜树碱 7-ethyl-10-hydroxycamptothecin |
| 7-甲氧基-芒果苷 7-O-Methylmangiferin |
| 7-甲氧基香豆素 7-Methoxycoumarin |
| 7-羟基香豆素 7-Hydroxycoumarin |
| 7-表-10-脱乙酰基紫杉醇 10-Desacetyltaxol +Na |
| 8-O-乙酰山栀苷甲酯 8-O-acetyl shanzhiside methyl ester +HCOOH |
| 8-O-乙酰山栀苷甲酯 8-O-acetyl shanzhiside methyl ester+ Na |
| 8-姜酚 8-Gingerol |
| 8-羟基-6,7- 二甲氧基香豆素 8-hydroxy-6,7-dimethoxycoumarin |
| 8-羟基补骨脂素 Xanthotoxol |
| 8-表马钱子酸 8-Epiloganic acid |
| 8-香叶草氧基补骨脂素 Xanthotoxol geranyl ether |
| Corylifol A |
| DL-麻黄碱 DL-Ephedrine |
| D-半乳糖 D-Galactose |
| D-无水葡萄糖 D-(+)-Glucose |
| D-木糖 D-Xylose |
| D-氨基葡萄糖 Glucosamine |
| D-甘露糖 D-(+)-Mannose |
| D-苏氨酸 Threonine |
| L-苹果酸 L-Malic acid |
| L-茶氨酸 L-Theanine |
| Menadione (Vitamin K3) Bisulfurous Acid |
| p- 茴香酸 p-Anisic acid |
| p-香豆酸 p-Coumaric acid |
| α-三联噻吩 2,2':5',2''-Terthiophene |
| α-倒捻子素 α-Mangostin |
| α-常春藤皂苷 α-Hederin +HCOOH |
| α-香附酮 α-Cyperone |
| β,β-二甲基丙烯酰阿卡宁 β,β-Dimethylacrylalkannin |
| β-胡萝卜素 β-Carotene |
| β-蜕皮激素 Hydroxyecdysone |
| β-蜕皮激素 Hydroxyecdysone +HCOOH |
| β-蜕皮甾酮 β-Ecdysone |
| β-蜕皮甾酮 β-Ecdysone +HCOOH |
| γ-氨基丁酸 GABA |
| 丁二酸 Amber Acid |
| 丁基东莨菪碱 Butylscopolamine |
| 丁香苷 Syringin +HCOOH |
| 丁香苷 Syringin +Na |
| 丁香苷 Syringin +NH3 |
| 丁香醛 Syringaldehyde |
| 七叶胆苷XVII Gypenoside XVII |
| 七叶胆苷XVII Gypenoside XVII +HCOOH |
| 三七皂苷Fe Notoginsenoside Fe |
| 三七皂苷Fe Notoginsenoside Fe +HCOOH |
| 三七皂苷Ft1 Notoginsenoside Ft1 |
| 三七皂苷Ft1 Notoginsenoside Ft1 +HCOOH |
| 三七皂苷R1 Notoginsenoside R1 |
| 三叶豆紫檀苷 Trifolirhizin +HCOOH |
| 三尖杉宁碱 Cephalomannine |
| 三氯蔗糖 Sucralose |
| 三氯蔗糖 Sucralose +Na |
| 三氯蔗糖 Sucralose +NH3 |
| 三白草酮 Sauchinone |
| 三聚氰胺 Melamine |
| 丙氨酸 Alanine |
| 东莨菪内酯 Scopoletin |
| 东莨菪碱 Scopolamine |
| 东莨菪苷 Scopolin |
| 丝氨酸 Serine |
| 丝石竹皂苷元-3-O-β-D-葡萄糖醛酸甲酯 Methyl(gypsogenin-3-O-β-D-glucopyranoside)uronate +NH3 |
| 两面针碱 Nitidine |
| 丹参素 Danshensu |
| 丹参酮 IIA Tanshinone IIA |
| 丹参酮ⅠTanshinone I |
| 丹参酮IIA磺酸 Tanshinone IIA-sulfonic acid |
| 丹皮酚 Paeonol |
| 丹酚酸A Salvianolic acid A |
| 丹酚酸B Salvianolic acid B |
| 乌头碱 Aconitine |
| 乌药醚内酯 Linderane |
| 乔松素 Pinocembrin |
| 乙酰化白藜芦醇 Acetyl-trans-resveratrol |
| 乙酰哈巴苷 8-O-Acetylharpagide |
| 乙酰哈巴苷 8-O-Acetylharpagide +HCOOH |
| 乙酰哈巴苷 8-O-Acetylharpagide +NH3 |
| 乙酸龙脑酯 Bomyl acetate |
| 二氢丹参酮（二氢丹参酮Ⅰ）Dihydrotanshinone I |
| 二氢大豆苷元 Dihydrodaidzein |
| 二氢杨梅素 Dihydromyricetin |
| 二氢欧山芹醇当归酸酯 Columbianadin |
| 二氢欧山芹醇当归酸酯 Columbianadin +Na |
| 二氢辣椒素 Dihydrocapsaicin |
| 五味子丙素 Schisandrin C |
| 五味子乙素 Schisandrin B |
| 五味子甲素 Schisandrin A |
| 五味子酚 Schisanhenol |
| 五味子酯甲 Schisantherin A |
| 五味子醇乙 Schizandrol B |
| 五味子醇甲 Schisandrin |
| 亚油酸 Linoleic acid |
| 亚油酸甲酯 Methyl linoleate |
| 亚麻木酚素 Secoisolariciresinol diglucoside +HCOOH |
| 亚麻木酚素 Secoisolariciresinol diglucoside +NH3 |
| 亥茅酚苷 Hamaudol Glycoside |
| 亥茅酚苷 Hamaudol Glycoside +HCOOH |
| 京尼平 Genipin |
| 京尼平苷 Geniposide |
| 京尼平苷 Geniposide + HCOOH |
| 京尼平苷 Geniposide +HCOOH |
| 京尼平苷 Geniposide +NH3 |
| 京尼平苷酸 Geniposidic acid |
| 亮氨酸 Leucine |
| 人参三醇 Panaxatriol |
| 人参二醇 Panaxadiol |
| 人参环氧炔醇 Panaxydol |
| 人参皂苷CK Ginsenoside CK +HCOOH |
| 人参皂苷CK Ginsenoside CK +Na |
| 人参皂苷F1 Ginsenoside F1 +HCOOH |
| 人参皂苷F1 Ginsenoside F1 +Na |
| 人参皂苷F2 Ginsenoside F2 +HCOOH |
| 人参皂苷F2 Ginsenoside F2 +Na |
| 人参皂苷Rb1 Ginsenoside Rb1 +HCOOH |
| 人参皂苷Rb2 Ginsenoside Rb2 |
| 人参皂苷Rb2 Ginsenoside Rb2 +HCOOH |
| 人参皂苷Rb2 Ginsenoside Rb2 +Na |
| 人参皂苷Rb3 Ginsenoside Rb3 |
| 人参皂苷Rb3 Ginsenoside Rb3 +HCOOH |
| 人参皂苷Rb3 Ginsenoside Rb3 +Na |
| 人参皂苷Rc Ginsenoside Rc |
| 人参皂苷Rc Ginsenoside Rc +HCOOH |
| 人参皂苷Rd Ginsenoside Rd +HCOOH |
| 人参皂苷Re Ginsenoside Re +HCOOH |
| 人参皂苷Rf Ginsenoside Rf +HCOOH |
| 人参皂苷Rg1 Ginsenoside Rg1 +HCOOH |
| 人参皂苷Rg2 Ginsenoside Rg2 |
| 人参皂苷Rg2 Ginsenoside Rg2 +HCOOH |
| 人参皂苷Rh1 Ginsenoside Rh1 +HCOOH |
| 人参皂苷Ro Ginsenoside-Ro |
| 仙茅苷 Curculigoside |
| 仙茅苷 Curculigoside + Na |
| 仙茅苷 Curculigoside +HCOOH |
| 仙鹤草酚B Agrimol B |
| 伊立替康 Irinotecan |
| 伪麻黄碱 Pseudoephedrine |
| 佛手苷内酯 Bergapten |
| 依托泊苷 Etoposide |
| 依托泊苷 Etoposide +NH3 |
| 儿茶素 Catechin |
| 儿茶素没食子酸酯 (-)-Catechin Gallate |
| 光甘草定 Glabridin |
| 党参炔苷 Lobetyolin +HCOOH |
| 六氢吡啶羧酸 Pipecolinic acid |
| 关附甲素 Guan-fu base A |
| 冬凌草甲素 Oridonin |
| 利血平 Reserpine |
| 刺五加苷B Syringin +Na |
| 刺五加苷B Syringin +HCOOH |
| 刺五加苷E Eleutheroside E +HCOOH |
| 刺五加苷E Eleutheroside E +NH3 |
| 刺囊酸 Echinocystic acid |
| 刺果甘草苷D Licoagroside D |
| 剑麻皂苷元 Tigogenin |
| 千金子甾醇 Euphorbiasteroid |
| 千金子甾醇 Euphorbiasteroid+Na |
| 千金藤素 Cepharanthine |
| 升麻素 Cimifugin |
| 升麻素苷 Prim-O-glucosylcimifugin |
| 华蟾酥毒基 Cinobufagin |
| 厚朴酚 Magnolol |
| 原人参二醇 Protopanaxadiol +HCOOH |
| 原儿茶酸 Protocatechuic acid |
| 原儿茶醛 Protocatechuic Aldehyde |
| 原花青素B2（原矢车菊素B2）Procyanidin B2 |
| 原薯蓣皂苷 Protodioscin |
| 原薯蓣皂苷 Protodioscin +HCOOH |
| 原阿片碱 Protopine |
| 去乙酰车叶草苷酸甲酯 Deacetyl asperulosidic acid methyl ester +NH3 |
| 去乙酰车叶草苷酸甲酯 Deacetyl asperulosidic acid methyl ester |
| 去乙酰车叶草苷酸甲酯 Deacetyl asperulosidic acid methyl ester +Na |
| 去乙酰车叶草酸 10-Deacetylasperulosidic acid |
| 去乙酰车叶草酸 10-Deacetylasperulosidic acid +Na |
| 去乙酰车叶草酸 10-Deacetylasperulosidic acid +NH3 |
| 去二甲氧基姜黄素 Bisdemethoxycurcumin |
| 去氢二异丁香酚 Dehydrodiisoeugenol |
| 去氢木香内酯 Dehydrocostus lactone |
| 去氢钩藤碱 Corynoxeine |
| 去氢骆驼蓬碱 Harmine |
| 去氧胆酸 Deoxycholic acid |
| 去甲乌药碱 Higenamine |
| 去甲异波尔定 Norisoboldine |
| 去甲斑蝥素 Norcantharidin |
| 去甲氧基姜黄素 Demethoxycurcumin |
| 去甲泽拉木醛 Demethylzeylasteral |
| 双氢青蒿素 Dihydroartemisinin |
| 双醋瑞因 Diacerein |
| 反式茴香脑 Anise oil |
| 古伦宾 Columbin +HCOOH |
| 可可碱 Theobromine |
| 可待因 Codeine |
| 叶酸 Folic acid |
| 吴茱萸次碱 Rutaecarpine |
| 吴茱萸碱 Evodiamine |
| 呋喃二烯 Furanodiene |
| 和厚朴酚 Honokiol |
| 咖啡因 Caffeine |
| 咖啡酸 Caffeic acid |
| 咪达唑仑 Midazolam |
| 哈巴俄苷 Harpagosid |
| 哈巴俄苷 Harpagosid +HCOOH |
| 哈巴苷 Harpagide |
| 哈巴苷 Harpagide +NH3 |
| 商陆皂苷元 Phytolaccagenin |
| 商陆皂苷元 Phytolaccagenin +HCOOH |
| 商陆皂苷元 Phytolaccagenin +Na |
| 商陆皂苷甲 Esculentoside A |
| 喜树碱 Camptothecin |
| 四氢小檗碱 Canadine |
| 四氢药根碱 Tetrahydrojatrorrhizine |
| 土木香内酯 Alantolactone |
| 土荆皮乙酸 Pseudolaric acid B +NH3 |
| 土荆皮乙酸 Pseudolaric acid B |
| 圣草酚 Eriodictyol |
| 地榆皂苷Ⅰ Ziyuglycoside I |
| 地榆皂苷Ⅱ Ziyuglycoside II |
| 地肤子皂苷Ic Momordin Ic |
| 地肤子皂苷Ic Momordin Ic +NH3 |
| 地高辛 Digoxin |
| 地黄苷D Rehmannioside D |
| 地黄苷D Rehmannioside D +HCOOH |
| 地黄苷D Rehmannioside D +Na |
| 地黄苷D Rehmannioside D +NH3 |
| 士的宁 Strychnine |
| 夏佛塔苷 Schaftoside |
| 多烯紫杉醇 Docetaxel +HCOOH |
| 多烯紫杉醇 Docetaxel +Na |
| 大叶茜草素 Mollugin |
| 大波斯菊苷 Apigenin-7-glucoside |
| 大豆苷 Daidzin |
| 大豆苷 Daidzin +HCOOH |
| 大豆苷元 Daidzein |
| 大车前苷 Plantamajoside |
| 大麦芽碱 Hordenine |
| 大黄素 Emodin |
| 大黄素甲醚 Physcion |
| 大黄素葡萄糖苷 Emodin-8-glucoside |
| 大黄素葡萄糖苷 Emodin-8-glucoside +Na |
| 大黄酚 Chrysophanol |
| 大黄酸 Rhein |
| 天冬氨酸 Aspartic acid |
| 天麻素 Gastrodin |
| 太子参环肽B Heterophyllin B |
| 奇壬醇 Kirenol +HCOOH |
| 奇壬醇 Kirenol +NH3 |
| 奎宁酸 Quinic acid |
| 女贞苷 Ligustroflavone |
| 姜糖脂B Gingerglycolipid B +HCOOH |
| 姜糖脂B Gingerglycolipid B +Na |
| 姜黄素 Curcumin |
| 孕烯醇酮 Pregnenolone |
| 它波宁 Tabersonine |
| 安五脂素 (+)-Anwulignan |
| 安五脂素 (+)-Anwulignan +NH3 |
| 宝藿苷Ⅰ Baohuoside I |
| 富马酸（延胡索酸） Fumaric acid |
| 对二氨基苯甲醛 4-Dimethylaminobenzaldehyde |
| 对叶百部碱 Tuberostemonine |
| 对羟基苯乙酮 4'-Hydroxyacetophenone |
| 对羟基苯甲酸 4-Hydroxybenzoic acid |
| 对羟基苯甲酸丁酯 Butylparaben |
| 射干苷 Tectoridin |
| 射干苷元 Tectorigenin |
| 小檗碱 Berberine |
| 小檗红碱 Berberrubine |
| 小白菊内酯 Parthenolide |
| 小豆蔻明 Cardamonin |
| 尼泊金甲酯 Methyl 4-hydroxybenzoate |
| 尿苷 Uridine |
| 山奈素 Kaempferide |
| 山奈酚 Kaempferol |
| 山姜素 Alpinetin |
| 山柰素 Kaempferide |
| 山柰苷 Kaempferitrin |
| 山柰酚-3-O-芸香糖苷 Aempferol-3-O-rutinoside |
| 山柰酚-3-O-龙胆二糖苷 Kaempferol-3-gentiobioside |
| 山栀苷甲酯 Dipsacoside B |
| 山栀苷甲酯 Dipsacoside B +HCOOH |
| 山梨糖醇 Sorbitol |
| 山麦冬皂苷 B Liriopesides B |
| 山麦冬皂苷 B Liriopesides B +HCOOH |
| 岩白菜素 Bergeninum |
| 川楝素 Toosendanin |
| 川楝素 Toosendanin +HCOOH |
| 川楝素 Toosendanin +Na |
| 川续断皂苷Ⅵ Asperosaponin Ⅵ +HCOOH |
| 川续断皂苷Ⅵ Asperosaponin Ⅵ |
| 川续断皂苷乙 Dipsacoside B |
| 川续断皂苷乙 Dipsacoside B +HCOOH |
| 川续断皂苷乙 Dipsacoside B +NH3 |
| 川芎嗪 Ligustrazine |
| 川陈皮素 Nobiletin |
| 左旋多巴 Levodopa |
| 左旋紫草素 Shikonin |
| 左旋肉碱 L-Carnitine |
| 巴西苏木素 Brazilin |
| 巴豆苷 2-Hydroxyadenosine |
| 巴马汀 Palmatine |
| 常春藤皂苷元 Hederagenin |
| 常春藤皂苷元 Hederagenin +Na |
| 广藿香酮 Pogostone |
| 广防风苷A Epimeredinoside A |
| 延胡索乙素 Tetrahydropalmatine |
| 延胡索甲素 Corydaline |
| 延龄草苷 Diosgenin Glucoside |
| 异东莨菪内酯 Isoscopoletin |
| 异亮氨酸 Isoleucine |
| 异亮氨酸（L-异亮氨酸） Isoleucine |
| 异去氢钩藤碱 Isocorynoxeine |
| 异嗪皮啶 Isofraxidin |
| 异土木香内酯 Isoalantolactone |
| 异型南五味子丁素 HeteroclitinD |
| 异夏佛塔苷 Isoschaftoside |
| 异川楝素 Isotoosendanin |
| 异川楝素 Isotoosendanin +Na |
| 异微凸剑叶莎醇 Isomucronulatol |
| 异槲皮素（异槲皮苷）槲皮素-3-O-葡萄糖苷 Isoquercitrin |
| 异欧前胡素 Isoimperatorin |
| 异泽兰黄素 Eupatilin |
| 异牡荆苷 Isovitexin |
| 异甘草素 Isoliquiritigenin |
| 异甘草苷 Isoliquiritin |
| 异紫花前胡内酯 Marmesin |
| 异绿原酸（3,5-二咖啡酰奎宁酸） Isochlorogenic acid A; 3,5-Di-O-caffeoylquinic acid |
| 异绿原酸A（3,4-O-二咖啡酰奎宁酸）Isochlorogenic acid A |
| 异绿原酸B（3,4-O-二咖啡酰奎宁酸）Isochlorogenic acid B |
| 异绿原酸B（3,4-二咖啡酰奎宁酸）Isochlorogenic acid B |
| 异绿原酸C（4,5-二咖啡酰奎宁酸）Isochlorogenic acid C |
| 异肉苁蓉苷 Ciso-Cistanoside C |
| 异茴芹内酯 Isopimpinellin |
| 异荭草素 Homoorientin (Isoorientin) |
| 异莲心碱 Isoliensinine |
| 异虎耳草素 Isopimpinellin |
| 异虎耳草素 Isopimpinellin +NH3 |
| 异补骨脂二氢黄酮 Isobavachin |
| 异补骨脂素 Angelicin |
| 异贝壳杉烯酸 Kaurenoic acid |
| 异钩藤碱 (±)-Isorhynchophylline |
| 异阿魏酸 Isoferulic acid |
| 异香草醛 Isovanillin |
| 异麦角甾苷/异毛蕊花糖苷/异类叶升 IsoActeoside |
| 异麦角甾苷/异毛蕊花糖苷/异类叶升 IsoActeoside +NH3 |
| 异鼠李素 Isorhamnetin |
| 异鼠李素-3-O-新橙皮苷 Isorhamnetin-3-O-neohespeidoside |
| 当药苷 Sweroside +HCOOH |
| 当药苷 Sweroside |
| 扑尔敏 Chlorpheniramine |
| 拓扑替康 Topotecan |
| 拟人参皂苷F11 Pseuoginsenoside F11 |
| 拟人参皂苷F11 Pseuoginsenoside F11 +HCOOH |
| 拟人参皂苷RT5 Pseudoginsenoside-RT5 |
| 拟人参皂苷RT5 Pseudoginsenoside-RT5 +HCOOH |
| 文多灵 Vindoline |
| 斑蝥素 Cantharidin |
| 斯皮诺素 Spinosin |
| 新乌头碱 Mesaconitine |
| 新北美圣草 Neoeriocitrin |
| 新女贞苷 Neonuezhenide |
| 新女贞苷 Neonuezhenide +Na |
| 新橙皮苷 Neohesperidin |
| 新橙皮苷二氢查耳酮 Neohesperidin dihydrochalcone |
| 新穿心莲内酯 Neoandrographolide |
| 新穿心莲内酯 Neoandrographolide +HCOOH |
| 新绿原酸 Neochlorogenic acid |
| 新芒果苷 Neo-mangiferin |
| 新补骨脂异黄酮 Neobavaisoflavone |
| 旱莲苷 A Ecliptasaponin A |
| 曲克芦丁 Troxerutin |
| 曲克芦丁 Troxerutin +HCOOH |
| 曲克芦丁 Troxerutin +Na |
| 朝藿定 A Epimedin A +HCOOH |
| 朝藿定 B Epimedin B |
| 朝藿定A Epimedin A |
| 朝藿定B Epimedin B +HCOOH |
| 朝藿定C Epimedin C |
| 木兰脂素 Magnolin |
| 木兰花碱 Magnoflorine |
| 木犀草素 Luteolin |
| 木犀草素-7-O-β-D-葡萄糖醛酸苷 Luteolin-7-O-β-D-glucuronide |
| 木犀草苷 Luteoloside |
| 木糖醇 Xylitol |
| 木蝴蝶苷B Oroxin B |
| 木通苯乙醇苷B Calceorioside B |
| 木香烃内酯 Costunolide |
| 杜鹃素 Farrerol |
| 杠柳毒苷 Periplocoside |
| 杠柳毒苷 Periplocoside +HCOOH |
| 杨梅素 Myricetin |
| 杨梅苷 Myricitrin |
| 杯苋甾酮 Cyasterone |
| 松果菊苷 Echinacoside |
| 松果菊苷 Echinacoside +NH3 |
| 松脂素单甲基醚-D-葡萄糖苷（松脂醇-4-O-BETA-D-吡喃葡萄糖苷）Pinoresinol-glucoside |
| 松脂醇二氢葡萄糖苷 Pinoresinol Diglucoside |
| 松脂醇二葡萄糖苷 Pinoresinol Diglucoside |
| 松脂醇二葡萄糖苷 Pinoresinol Diglucoside +HCOOH |
| 松脂醇二葡萄糖苷 Pinoresinol Diglucoside +NH3 |
| 松萝酸 Usnic acid |
| 染料木素 Genistein |
| 染料木苷 Genistin |
| 柚皮素 Naringenin |
| 柚皮苷 Naringin |
| 柚皮苷 Naringin+Na |
| 柚皮苷二氢查尔酮 Naringin dihydrochalcone |
| 柠檬苦素 Limonin |
| 柠檬酸 Citric acid |
| 柠檬黄 Tartrazine |
| 柯里拉京 Corilagin |
| 柯里拉京 Corilagin +Na |
| 柳穿鱼叶苷 Pectolinarin |
| 柳穿鱼黄素 Pectolinarigenin |
| 柴胡皂苷a Saikosaponin A +HCOOH |
| 柴胡皂苷B2 Saikosaponin B2 |
| 柴胡皂苷B4 Saikosaponin B4 |
| 柴胡皂苷C Saikosaponin C |
| 柴胡皂苷C Saikosaponin C +HCOOH |
| 柴胡皂苷d Saikosaponin D |
| 柴胡皂苷D Saikosaponin D +HCOOH |
| 栀子苷 Gardenoside |
| 栀子苷 Gardenoside +HCOOH |
| 栀子苷 Gardenoside +Na |
| 栀子苷 Gardenoside +NH3 |
| 栎瘿酸 Roburic acid |
| 根皮苷 Phloridzin |
| 格列本脲 Glibenclamide |
| 格列风内酯 Griffonilide |
| 桂皮醛 Cinnamaldehyde |
| 桃叶珊瑚苷 Aucubin |
| 桃叶珊瑚苷 Aucubin +HCOOH |
| 桑皮苷A Mulberroside A |
| 桑皮苷A Mulberroside A +HCOOH |
| 桑色素 Morin hydrate |
| 桔梗皂苷D Platycodin D |
| 梓醇 Catalpol |
| 梣酮 Fraxinellone |
| 棉酚 Gossypol |
| 椴树苷 Tiliroside |
| 槐定碱 Sophoridine |
| 槐果碱 Sophocarpine |
| 槐角苷 Sophoricoside |
| 槟榔碱 Arecoline |
| 槲皮素 Quercetin |
| 槲皮素-3'-O-葡萄糖苷 Quercetin-3'-O-glucoside |
| 槲皮苷 Quercitrin |
| 樟脑 Camphor |
| 樨草素（木犀草素） Luteolin |
| 樨草苷(木犀草苷) Luteolin-7-O-β-D-glucoside |
| 橄榄苦苷 Oleuropein |
| 橘皮素 Tangeretin |
| 橙皮素 Hesperetin |
| 橙皮苷 Hesperidin |
| 橙黄决明素 Aurantio-Obtusin |
| 次乌头碱 Hypaconitine |
| 次野鸢尾黄素 Irisflorentin |
| 次黄嘌呤 6-Hydroxypurine |
| 欧前胡素 Imperatorin |
| 欧当归内酯A Levistilide A |
| 欧当归内酯A Levistilide A +NH3 |
| 款冬酮 Tussilagone |
| 毕扣扣灵碱 Bicuculline |
| 毛两面针素 Toddalolactone |
| 毛兰素 Erianin |
| 毛柳苷 Salidroide |
| 毛柳苷 Salidroide+NH3 |
| 毛蕊异黄酮 Calycosin |
| 毛蕊异黄酮苷 Calycosin-7-O-glucoside |
| 毛蕊异黄酮苷 Calycosin-7-o-glucoside +HCOOH |
| 毛蕊花糖苷 Acteoside +NH3 |
| 毛蕊花糖苷 Acteoside; Verbascoside; Kusaginin |
| 氧化前胡素 Oxypeucedanin |
| 氧化槐果碱 Oxysophocarpine |
| 氧化白藜芦醇 Oxyresveratrol |
| 氧化苦参碱 Oxymatrine |
| 氨桂皮酸 p-Aminocinnamic acid |
| 氯氮卓 Chlordiazepoxide |
| 氯雷他定 Loratadine |
| 水仙苷 Narcissoside |
| 水合氧化前胡素 Oxypeucedanin hydrate |
| 水晶兰苷 Monotropein |
| 水杨苷 Salicin |
| 水杨苷 Salicin +HCOOH |
| 水杨酸 Salicylic acid |
| 水苏碱 Stachydrine |
| 水飞蓟宾 Silymarin |
| 汉黄芩素 Wogonin |
| 汉黄芩苷 Wogonin 7-O-glucuronide |
| 沉香四醇 Agarotetrol |
| 沙苑子苷 Complanatoside |
| 沙苑子苷 Complanatoside +HCOOH |
| 沙蟾毒精 Arenobufagin |
| 没食子儿茶素 (-)-Gallocatechin |
| 没食子酸 Gallic acid |
| 没食子酸丙酯 Benzoic acid |
| 洋地黄毒苷 Digitoxin |
| 洋地黄毒苷 Digitoxin +HCOOH |
| 洋川芎内酯ⅠSenkyunolide I |
| 洋川芎内酯A 3-N-butyl-4,5-dihydrophthalide |
| 海柯皂苷元 Hecogenin |
| 淫羊藿素 Icaritin |
| 淫羊藿苷 Icarrin |
| 淫羊藿苷 Icarrin +HCOOH |
| 滨蒿内酯 6,7-Dimethoxycoumarin |
| 漆黄素 Fisetin |
| 澳洲茄胺 Solasodine |
| 澳洲茄边碱 Solasonine +HCOOH |
| 灵芝酸A Ganoderic acid A |
| 灵芝酸H Ganoderic acid H |
| 烟酰胺 Nicotinamide |
| 烟酸 Nicotinic acid |
| 熊去氧胆酸 Ursodeoxycholic Acid |
| 熊果苷 Arbutin |
| 熊果酸 Ursolic Acid |
| 牛磺熊去氧胆酸 Tauroursodeoxycholic acid |
| 牛磺熊去氧胆酸 Tauroursodeoxycholic acid +Na |
| 牛磺胆酸钠 Sodium Taurocholate |
| 牛磺脱氧胆酸钠 Sodium taurodeoxycholate |
| 牛磺酸 Taurine |
| 牛磺鹅去氧胆酸 Taurochenodeoxycholic acid +Na |
| 牛蒡子苷 Arctiin +Na |
| 牛蒡子苷 Arctiin +NH3 |
| 牛蒡子苷元 Arctigenin |
| 牛蒡苷 Arctiin +HCOOH |
| 牛蒡苷 Arctiin +NH3 |
| 牡荆素葡萄糖苷 Glucosylvitexin |
| 牡荆素鼠李糖苷 Vitexin-2-O-rhamnoside |
| 牡荆苷 Vitexin |
| 特女贞苷 Specnuezhenide |
| 特女贞苷 Specnuezhenide + HCOOH |
| 牻牛儿酮 Germacrone; (3E,7E)-3,7-dimethyl-10-propan-2-ylidenecyclodeca-3,7-dien-1-one |
| 猪去氧胆酸 Hyodeoxycholic acid |
| 獐牙菜苦苷 Swertimarin +HCOOH |
| 王不留行黄酮苷 Vaccarin |
| 环维黄杨星D Cyclovirobuxine D |
| 琥珀酸 Succinic acid |
| 瑞香素 Daphnetin |
| 瓜氨酸 Citrulline |
| 甘松新酮 Nardosinone |
| 甘氨熊去氧胆酸 Glycoursodeoxycholic acid |
| 甘氨胆酸 Glycocholic acid |
| 甘氨胆酸钠 Sodium glycocholate |
| 甘氨脱氧胆酸钠 Sodium glycodeoxycholate |
| 甘油三油酸酯 Glycerol Trioleate +NH3 |
| 甘草次酸 Glycyrrhetinic acid |
| 甘草素 Liquiritigenin |
| 甘草苷 Liquiritin |
| 甘草酸 Glycyrrhizic acid |
| 甘露醇 Mannitol |
| 甜菊苷 Stevioside |
| 甜菜碱 Betaine |
| 田基黄苷 Quercetin 7-rhamnoside; Vincetoxicoside B |
| 甲基橙皮苷 Methylhesperidin |
| 甲基莲心碱 Neferine |
| 甲基麦冬二氢高异黄酮A Methylophiopogonanone A |
| 甲基麦冬二氢高异黄酮B Methylophiopogonanone B |
| 甲基麦冬高异黄酮A Methylophiopogonone A |
| 番泻苷A Sennoside A |
| 番泻苷A Sennoside A +Na |
| 番泻苷B Sennoside B |
| 番泻苷B Sennoside B +Na |
| 番泻苷C Sennoside C |
| 白头翁皂苷B4 Anemoside B4 |
| 白屈菜红碱 Toddaline; Broussonpapyrine |
| 白术内酯I Atractylenolide I |
| 白术内酯III Atractylenolide Ⅲ |
| 白杨素 Chrysin |
| 白果内酯 Bilobalide |
| 白桦脂酸 Betulinic acid |
| 白桦脂醇 Betulin |
| 白皮杉醇 Piceatannol |
| 白花丹素 Plumbagin |
| 白花前胡丙素 Praeruptorin C +Na |
| 白花前胡乙素 Praeruptorin B |
| 白花前胡甲素 Praeruptorin A |
| 白花前胡素 E Praeruptorin E |
| 白藜芦醇 Resveratrol |
| 白藜芦醇三甲醚 3,4',5-Trimethoxy-trans-stilbene |
| 白鲜碱 Dictamnine |
| 百秋李醇 Patchouli alcohol (loss H20) |
| 益母草碱 Leonurine |
| 相思子碱 Abrine |
| 矢车菊素-3-O-葡萄糖苷 Cyanidin-3-O-glucoside |
| 知母皂苷BⅡ Timosaponin BII +HCOOH |
| 知母皂苷元；菝契皂苷元 Sarsasapogenin |
| 短葶山麦冬皂苷 C Liriope muscari baily saponins C |
| 短葶山麦冬皂苷 C Liriope muscari baily saponins C +HCOOH |
| 石吊兰素 Lysionotin |
| 石斛碱 Dendrobine |
| 石杉碱甲 Huperzine A |
| 石蒜碱 Lycorine |
| 硫辛酸 (R)-Lipoic acid |
| 秋水仙碱 Colchicine |
| 科罗索酸 Corosolic acid |
| 秦皮乙素 Esculetin |
| 秦皮甲素 Esculin hydrate |
| 秦皮素 Fraxetin |
| 秦皮苷 Fraxin |
| 秦皮苷 Fraxin +Na |
| 秦皮苷 Fraxin +NH3 |
| 积雪草苷 Asiaticoside +NH3 |
| 积雪草酸 Asiatic acid |
| 穗花杉双黄酮 Amentoflavone |
| 穿心莲内酯 Andrographolide +HCOOH |
| 穿心莲内酯 Andrographolide |
| 竹红菌乙素 Hypocrellin B |
| 竹节参皂苷Ⅳa Chikusetsusponin IVa |
| 竹节香附素A Raddeanin A +HCOOH |
| 竹节香附素A Raddeanin A +NH3 |
| 竹节香附素A Raddeanin A |
| 类叶升麻苷（毛蕊花糖苷）Verbascoside |
| 粉防己碱 (+)-Tetrandrine |
| 精氨酸L(+)-Arginine |
| 紫丁香苷 Syringa vulgaris + NH3 |
| 紫丁香苷 Syringa vulgaris +Na |
| 紫云英苷 Astragalin |
| 紫堇灵 Corynoline |
| 紫杉醇 Paclitaxel |
| 紫杉醇 Paclitaxel +HCOOH |
| 紫杉醇 Paclitaxel +Na |
| 紫檀芪 Pterostilbene |
| 紫花前胡苷 Nodakenin |
| 紫花前胡苷 Nodakenin +HCOOH |
| 紫草氰苷 Lithospermoside |
| 紫草酸 Linthospermic Acid +Na |
| 紫菀酮 Shionone |
| 红景天苷 Salidroside |
| 红景天苷 Salidroside +HCOOH |
| 红景天苷 Salidroside +NH3 |
| 红车轴草素-7-O-D-葡萄糖苷 Pratensein-7-O-glucoside |
| 纤细薯蓣皂苷 Gracillin |
| 纤细薯蓣皂苷 Gracillin +HCOOH |
| 组氨酸 Histidine |
| 细叶远志皂苷 Tenuifolin |
| 细辛脂素 Asarinin |
| 络石苷 Tracheloside +HCOOH |
| 络石苷 Tracheloside +NH3 |
| 维生素A Vitamin A |
| 维生素A酸 Vitamin A acid |
| 维生素B1 Vitamin B1 |
| 维生素B2 Vitamin B2 |
| 维生素B5 Vitamin B5 |
| 维生素B6 Vitamin B6 |
| 维生素C Vitamin C |
| 维生素D2 Vitamin D2 |
| 维生素D3 Vitamin D3 |
| 维生素K1 Vitamin K1 |
| 绿原酸 Chlorogenic acid |
| 缬氨酸 L-Valine |
| 缬草三酯 Valepotriate +Na |
| 罗通定 Rotundine |
| 羌活醇 Notopterol |
| 羟喜树碱 Hydroxycamptothecine |
| 羟基柠檬酸 Hydroxycitric acid |
| 羟基积雪草苷 Madecassoside |
| 羟基积雪草酸 Madecassic acid |
| 羟基红花黄色素A Hydroxysafflor Yellow A |
| 羟基芫花素 Hydroxygenkwanin |
| 羟基茜草素 Purpurin |
| 羟基酪醇 Hydroxytyrosol |
| 羟苯乙酯 Ethyl 4-hydroxybenzoate |
| 老鹳草素 Geraniin |
| 老鹳草素 Geraniin +Na |
| 耐斯糖 Fungitetraose |
| 肉桂酸 Cinnamic acid |
| 肉苁蓉苷D Cistanoside D |
| 肉苁蓉苷D Cistanoside D +HCOOH |
| 肉苁蓉苷D Cistanoside D +NH3 |
| 肉豆蔻木脂素 Myrislignan |
| 育亨宾 Yohimbine |
| 胆红素 Bilirubin |
| 胆酸 Cholan-24-oic acid |
| 胞苷 Cytidine |
| 胡椒碱 Piperine |
| 胡芦巴碱 Trigonelline |
| 胡薄荷酮 Pulegone |
| 胡麻属苷 Sesamoside +HCOOH |
| 胡麻属苷 Sesamoside +Na |
| 胡黄连苷Ⅰ PicrosideⅠ |
| 胡黄连苷Ⅱ PicrosideII |
| 胭脂红 Acid Red (Salt of Sodium) |
| 胸腺嘧啶 Thymine |
| 脯氨酸 Proline |
| 脱氢紫堇碱 Dehydrocorydaline |
| 脱水穿心莲内酯 Dehydroandrographolide |
| 脱水穿心莲内酯琥珀酸半酯 Butanedioicacid |
| 腺嘌呤 Adenine |
| 腺苷 Adenosine |
| 色氨酸 L-Tryptophan |
| 芍药内酯苷 Albiflorin |
| 芍药苷 Paeoniflorin |
| 芍药苷 Paeoniflorin +HCOOH |
| 芍药苷 Paeoniflorin +NH3 |
| 芒果苷 Mangiferin |
| 芒柄花素 Formononetin |
| 芒柄花苷 Ononin |
| 芒柄花苷 Ononin +HCOOH |
| 芝麻素 Sesamin |
| 芝麻酚 Sesamol |
| 芥子碱 Sinapine |
| 芦丁 Rutin |
| 芦竹碱 Gramine |
| 芦荟大黄素 Aloe-Emodine |
| 芦荟苷 Aloin, Barbaloin |
| 芦西定 Lucidin |
| 芫花素 Genkwanin |
| 花旗松素 Dihydroquercetin |
| 花椒毒素 Methoxsalen |
| 花椒毒酚 Xanthotoxol |
| 芸香柚皮苷 Narirutin |
| 芹菜素 Apigenin |
| 芹菜素-7-O-β-D-葡萄糖醛酸苷 Apigenin 7-O-beta-D-glucuronide |
| 苋菜红 Amaranth |
| 苍术苷 Atractyloside |
| 苔黑酚葡萄糖苷 Orcinol glucosid |
| 苔黑酚葡萄糖苷 Orcinol glucosid +HCOOH |
| 苦参碱 Matrine |
| 苦杏仁苷 Amygdalin |
| 苦杏仁苷 Amygdalin +NH3 |
| 苦玄参苷IA Piefeltarraenin IA |
| 苦玄参苷IA Piefeltarraenin IA +NH3 |
| 苦玄参苷IB Picfeltarraenin IB |
| 苦玄参苷IB Picfeltarraenin IB +HCOOH |
| 苦蒿素 Blinin +HCOOH |
| 苯丙氨酸 Phenprobamate |
| 苯丙氨酸 Phenylalanine |
| 苯巴比妥Phenobarbital |
| 苯甲酰新乌头原碱 Benzoylmesaconine |
| 苯甲酰次乌头原碱 Benzoylhypacoitine |
| 苯甲酰芍药苷 Benzoylpaeoniflorin |
| 苯甲酰芍药苷 Benzoylpaeoniflorin +NH3 |
| 茄尼醇 Solanesol |
| 茯苓酸 Pachymic acid |
| 茴香醛 Anisaldehyde |
| 茶碱 Theophylline |
| 草乌甲素 Bulleyaconitine A |
| 草夹竹桃苷 Androsin |
| 草质素苷 Rhodionin |
| 荭草苷 Orientin |
| 药根碱 Jatrorrhizine |
| 荷叶碱 Nuciferin |
| 莪术二酮 Curdione |
| 莪术醇 Curcumol |
| 莫诺苷 Morroniside +HCOOH |
| 莱苞迪苷A Rebaudioside A |
| 莱苞迪苷A Rebaudioside A +NH3 |
| 莲心碱 Liensinine |
| 莽草酸 Shikimic acid |
| 菊苣酸 Cichoric acid |
| 菊苣酸 Cichoric acid +Na |
| 菜油甾醇 Campesterol |
| 落新妇苷 Astilbin |
| 葛根素 Puerarin |
| 葫芦素B Cucurbitacin B +HCOOH |
| 葫芦素B Cucurbitacin B +Na |
| 蒙花苷 Linarin |
| 蒿甲醚 Artemtherin +Na |
| 蔓荆子黄素 Vitexicarpin |
| 薯蓣皂苷 Dioscin +HCOOH |
| 薯蓣皂苷元 Diosgenin |
| 藁本内酯 Ligustilide |
| 藜芦酸 3,4-Dimethoxybenzoic acid |
| 藤黄酸 Gambogic acid |
| 虎杖苷 Polydatin |
| 虎杖苷 Polydatin +HCOOH |
| 虫草素 Cordycepin |
| 蛇床子素 Osthole |
| 蝙蝠葛碱 Dauricine |
| 蝙蝠葛苏林碱 Daurisoline |
| 蟛蜞菊内酯 Wedelolactone |
| 蟾毒它灵 Bufotaline |
| 蟾毒灵 Bufalin |
| 血根碱 Sanguinarine |
| 血竭 Dracorhodin |
| 补骨脂乙素 Isobavachalcone |
| 补骨脂二氢黄酮甲醚 Bavachinin A |
| 补骨脂宁 Corylin |
| 补骨脂定 Psoralidin |
| 补骨脂甲素 Bavachin |
| 补骨脂素 Psoralen |
| 补骨脂酚 Bakuchiol |
| 表儿茶素 Epicatechin |
| 表儿茶素没食子酸酯 Epicatechin Gallate |
| 表小檗碱 Epiberberine |
| 表木栓醇 Epifriedelanol |
| 表没食子儿茶素没食子酸酯 (-)-Epigallocatechin Gallate |
| 表油菜素内酯 Epibrassinolide |
| 表油菜素内酯 Epibrassinolide +HCOOH |
| 西伯利亚远志糖A5 Sibiricose A5 |
| 西伯利亚远志糖A6 Sibiricose A6 |
| 西布曲明 Sibutramine |
| 西瑞香素 Daphnoretin |
| 西红花苷-Ⅰ Crocin I |
| 西红花苷-Ⅰ Crocin I +Na |
| 西红花酸 Crocetin |
| 西贝母碱 Imperialine |
| 覆盆子酮 Raspberry Ketone |
| 诺米林 Nomilin |
| 谷氨酸 Glutamic acid |
| 豆腐果苷 Helicid |
| 贝母素乙 Peiminine |
| 贝母素甲 Peimine |
| 贝母辛 Peimisine |
| 路路通酸 Betulonicacid |
| 车前子苷 Plantagoside |
| 车叶草苷 Asperuloside |
| 辛夷脂素 Fargesin |
| 辣椒素 Capsaicin |
| 远志(口山)酮III Polygalaxanthone III |
| 远志口山酮Ⅲ Polygalaxanthone III |
| 远志口山酮Ⅲ Polygalaxanthone III +Na |
| 远志口山酮Ⅳ PolygalaxanthoneⅣ |
| 远志口山酮Ⅴ PolygalaxanthoneⅤ |
| 远志口山酮Ⅵ PolygalaxanthoneⅥ |
| 远志口山酮Ⅵ PolygalaxanthoneⅥ + HCOOH |
| 远志口山酮Ⅵ PolygalaxanthoneⅥ +Na |
| 远志口山酮Ⅶ PolygalaxanthoneⅦ |
| 远志口山酮Ⅷ PolygalaxanthonⅧ |
| 远志口山酮Ⅸ PolygalaxanthoneⅨ |
| 远志口山酮Ⅸ PolygalaxanthoneⅨ +HCOOH |
| 远志皂苷元 Senegenin |
| 远志皂苷元 Senegenin +NH3 |
| 远志糖苷A Tenuifoliside A |
| 远志糖苷B Tenuifoliside B |
| 远志酸 Polygalic acid |
| 连翘苷 PhillyrinForsythin +HCOOH |
| 连翘酯苷A Forsythoside A +NH3 |
| 连翘酯苷A Forsythoside A |
| 连翘酯苷B Forsythoside B |
| 连翘酯苷B Forsythoside B +NH3 |
| 迷迭香酸 Rosmarinic acid |
| 通关藤苷H Tenacissoside H |
| 通关藤苷H Tenacissoside H +NH3 |
| 酪醇 Tyrosol |
| 酯蟾毒配基 Resibufogenin |
| 酯蟾毒配基 Resibufogenin + HCOOH |
| 酸枣仁皂苷A Jujuboside A |
| 酸枣仁皂苷B Jujuboside B |
| 酸枣仁皂苷B Jujuboside B +HCOOH |
| 醉鱼草皂苷Ⅳb Clinodiside A |
| 重楼皂苷Ⅰ PolyphyllinⅠ |
| 重楼皂苷Ⅰ PolyphyllinⅠ +HCOOH |
| 重楼皂苷VI Polyphyllin VI |
| 重楼皂苷VI Polyphyllin VI +NH3 |
| 野漆树苷 Rhoifolin |
| 野百合碱 Monocrotaline |
| 野马追内酯 B Eupalinolide B |
| 野马追内酯A Eupalinolide A |
| 野黄芩素Scutellarein |
| 野黄芩苷 Scutellarin |
| 金丝桃素 Hypericin |
| 金丝桃苷 Hyperin |
| 金合欢素Acacetin |
| 金胺O Auramine O |
| 金腰乙素 Chrysosplenetin B |
| 金雀花碱 Cytisine |
| 钩藤碱 Rhynchophylline |
| 银杏内酯A Ginkgolide A |
| 银杏内酯B Ginkgolide B |
| 银杏内酯B Ginkgolide B +HCOOH |
| 银杏内酯B Ginkgolide B +NH3 |
| 银杏内酯C Ginkgolide C |
| 银杏酸C15:1 Ginkgolic Acid (C15:1) |
| 长春新碱 Vincristine |
| 长春瑞滨 Vinorelbine |
| 长春碱 Vinblastine |
| 长春质碱 Catharanthine |
| 长梗冬青苷 Pedunculoside +HCOOH |
| 长梗冬青苷 Pedunculoside +NH3 |
| 间甲氧基苯甲酸 3-Methoxybenzoic acid |
| 防己诺林碱 Fangchinoline, Hanfangchin B |
| 阿托品 Atropine |
| 阿拉伯糖 L(+)-Arabinose |
| 阿福豆苷 Afzelin |
| 阿魏酸 Ferulic Acid |
| 阿魏酸乙酯 Ethyl ferulate |
| 降龙涎香醚 Ambroxane |
| 隐丹参酮 Cryptotanshinone |
| 隐绿原酸 (5-咖啡酰奎宁酸) 4-O-Caffeoyl Quinic acid |
| 隐绿原酸Cryptochlorogenic acid |
| 雅姆皂苷元 Yamogenin |
| 雷公藤内酯甲 Wilforlide A |
| 雷公藤内酯酮 Triptonide |
| 雷公藤内酯醇 Triptolide |
| 雷公藤红素Celastrol |
| 青蒿素 Artemisinin |
| 青藤碱 Sinomenine |
| 青阳参苷元 Qingyangshengenin |
| 靛玉红 Indirubin |
| 靛蓝染料 Indigo Dye |
| 鞣花酸 Ellagic Acid |
| 香叶木素 Diosmetin |
| 香紫苏二醇 Sclareol Glycol |
| 香紫苏内酯 Sclareolide |
| 香紫苏醇 Sclareol +Na |
| 香荆芥酚 Carvacrol |
| 香草酸Vanillic acid |
| 香蒲新苷 Typhaneoside |
| 香豆素 Coumarin |
| 马兜铃酮 Aristolone |
| 马兜铃酸Ⅰ Aristolochic acids |
| 马兜铃酸B Aristolochic acid B |
| 马兜铃酸C Aristolochic acid C |
| 马兜铃酸C Aristolochic acid C +NH3 |
| 马兜铃酸D Aristolochic acid D |
| 马兜铃酸D Aristolochic acid D +NH3 |
| 马兜铃酸VIIa Aristolochic Acid VIIa |
| 马兜铃酸VIIa Aristolochic acid VIIa +NH3 |
| 马卡因 Maackiain |
| 马来酸 Maleic acid |
| 马钱子碱 Brucine |
| 马钱苷 Loganin |
| 马钱苷 Loganin +HCOOH |
| 马钱苷酸 Loganic acid |
| 高三尖杉酯碱 Homoharringtonine |
| 高乌甲素 Lappaconite |
| 高乌甲素 Lappaconite +HCOOH |
| 高良姜素 Galangin |
| 高香草酸 Homovanillic acid |
| 鬼臼毒素 Podophyllotoxin |
| 鲁斯可皂苷元 Ruscogenin |
| 鸟苷 Guanosine |
| 鹅去氢胆酸 Chenodeoxycholic acid +Na |
| 鹅去氧胆酸 Chenodeoxycholic acid |
| 鹰嘴豆芽素A Biochanin A |
| 麝香酮 Muscone |
| 麦冬皂苷 D' Ophiopogonin D |
| 麦冬皂苷 D Ophiopogonin D +HCOOH |
| 麦冬皂苷 D' Ophiopogonin D' +HCOOH |
| 麦冬黄烷酮 C Ophiopogonanone C |
| 麦冬黄烷酮 E |
| 麦芽五糖 Maltopentaose |
| 麻黄碱 Ephedrine |
| 黄杞苷 Engeletin |
| 黄柏碱 Phellodendrine |
| 黄柏酮 Obacunone |
| 黄独素B Diosbulbin B |
| 黄芩素 Baicalein |
| 黄芩苷 Baicalin |
| 黄芪异黄烷苷 Isomucronulatol-7-O-glucoside |
| 黄芪甲苷 Astragaloside Ⅳ |
| 黄芪甲苷 Astragaloside Ⅳ +HCOOH |
| 黄芪皂苷Ⅱ Astragaloside Ⅱ +HCOOH |
| 黄芪皂苷I Astragaloside I +HCOOH |
| 黄豆黄素 Glycetein |
| 黄豆黄苷 Glycitin |
| 黄连碱 Coptisine |
| 鼠尾草苦内酯 Carnosol |
| 鼠尾草酸 Carnosic acid |
| 齐墩果酸 Oleanolic acid |
| 龙胆苦苷 Gentiopicrin |
| 龙血素 A Loureirin A |
| 龙血素 B Loureirin B |
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