Exact Mass: 380.1754
Exact Mass Matches: 380.1754
Found 500 metabolites which its exact mass value is equals to given mass value 380.1754
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Vomicin
Vomicine is a member of carbazoles. Vomicine is a natural product found in Strychnos icaja, Strychnos wallichiana, and Strychnos nux-vomica with data available. Vomicine, an alkaloid, shows antidiabetic activity[1]. Vomicine, an alkaloid, shows antidiabetic activity[1].
Cinncassiol C
Cinncassiol C is found in herbs and spices. Cinncassiol C is a constituent of Cinnamomum cassia (Chinese cinnamon)
Di-4-coumaroylputrescine
Alkaloid from Helianthus annuus (sunflower), Pyrus communis (pear), Rubus idaeus (raspberry) and Vicia faba. Di-4-coumaroylputrescine is found in many foods, some of which are pomes, fruits, red raspberry, and pulses. Di-4-coumaroylputrescine is found in fats and oils. Di-4-coumaroylputrescine is an alkaloid from Helianthus annuus (sunflower), Pyrus communis (pear), Rubus idaeus (raspberry) and Vicia faba.
Prenyl arabinosyl-(1->6)-glucoside
Prenyl arabinosyl-(1->6)-glucoside is found in fruits. Prenyl arabinosyl-(1->6)-glucoside is a constituent of purple passion fruit Passiflora edulis. Constituent of purple passion fruit Passiflora edulis. Prenyl arabinosyl-(1->6)-glucoside is found in fruits.
Pteroside B
Pteroside B is found in green vegetables. Pteroside B is a constituent of Pteridium aquilinum (bracken fern)
Prenyl apiosyl-(1->6)-glucoside
Prenyl apiosyl-(1->6)-glucoside is found in alcoholic beverages. Prenyl apiosyl-(1->6)-glucoside is a constituent of a wine grape (Vitis vinifera) and Bupleurum falcatum
Deacetylisovaltrate
Constituent of Valeriana officinalis (valerian). Deacetylisovaltrate is found in tea, fats and oils, and herbs and spices. Deacetylisovaltrate is found in fats and oils. Deacetylisovaltrate is a constituent of Valeriana officinalis (valerian)
3-Methyl-3-butenyl apiosyl-(1->6)-glucoside
3-Methyl-3-butenyl apiosyl-(1->6)-glucoside is found in alcoholic beverages. 3-Methyl-3-butenyl apiosyl-(1->6)-glucoside is a constituent of a wine from grapes Vitis vinifera cv. Gewurztraminer
6b-Angeloyl-3b,8b,9b-trihydroxy-7(11)-eremophilen-12,8-olide
6b-Angeloyl-3b,8b,9b-trihydroxy-7(11)-eremophilen-12,8-olide is found in green vegetables. 6b-Angeloyl-3b,8b,9b-trihydroxy-7(11)-eremophilen-12,8-olide is a constituent of Petasites japonicus (sweet coltsfoot). Constituent of Petasites japonicus (sweet coltsfoot). 6b-Angeloyl-3b,8b,9b-trihydroxy-7(11)-eremophilen-12,8-olide is found in green vegetables.
(2S,3S)-1-[[2-Methoxy-5-(trifluoromethoxy)phenyl]methyl]-2-phenylpiperidin-3-amine
(2S,3S)-N-(2-Methoxy-5-(trifluoromethoxy)benzyl)-2-phenylpiperidin-3-amine
[(2S,3S,5R)-3-Azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl (2S,3S)-2-amino-3-methylpentanoate
[3aS-(3aR*,4R*,5R*,6R*,10E,11aS*)]-2,3,3a,4,5,6,7,8,9,11a-Decahydro-5,6-dihydroxy-6,10-dimethyl-3-methylene-2,7-dioxocyclodeca[b]furan-4-yl ester 3-methylbutanoic acid
Neurolenin C
A germacranolide isolated from Neurolaena lobata and Austroeupatorium inulifolium and has been shown to exhibit antimalarial activity.
3beta,4alpha,7beta,10beta-Tetrahydroxy-15,16-epoxy-labda-13(16),14-dien-20,12-olide
Neurolenin D
A germacranolide isolated from Neurolaena lobata and Austroeupatorium inulifolium and has been shown to exhibit antimalarial activity.
3alpha,4beta,8beta,10beta-Tetrahydroxy-15,16-epoxy-cis-clerodane-13(16),14-dien-20,12-olide
[3aR-[3aalpha,4beta(S*),6alpha,6aalpha,7beta,7abeta,8abeta,8balpha,8cbeta]]-Dodecahydro-6,7-dihydroxy-6,8a-dimethyl-3-methylene-2-oxooxireno[2,3]azuleno[4,5-b]furan-4-yl ester 2-methylbutanoic acid
[3aR-(3aalpha,4beta,6alpha,6aalpha,7beta,7abeta,8abeta,8balpha,8cbeta)]-Dodecahydro-6,7-dihydroxy-6,8a-dimethyl-3-methylene-2-oxooxireno[2,3]azuleno[4,5-b]furan-4-yl ester 3-methylbutanoic acid
(7E)-1-[(1E)-5-hydroxypent-1-en-1-yl]non-7-ene-3,5-diyn-1-yl beta-D-glucopyranoside|9-(beta-D-glucopyranosyloxy)tetradeca-2,10-diene-4,6-diyn-14-ol|cordifolioidyne C
8alpha-hydroxy-7,11-dehydro-senatractolide-6-O-2-methylbutyrate
2alpha-isovaleryloxy-3,8-dioxo-11-peroxy-4beta,5beta-epoxybisabola-8(14),9E-diene
8alpha-hydroxy-7,11-dehydro-senatractolide-6-O-isovalerate
7-(2-Methylbutanoyl),9-angeloyl: p-Mentha-1,3,5-triene-3,7,8,9,10-penol|9-Angeloyloxy-7-(2-methylbutyryloxy)-8,10-dihydroxy-thymol
1-acetyl-17,18-epoxy-11-methoxy-cura-2(16),19-dien-17-ol|Methoxy-2,16-dehydro-diabolin
6beta,7beta,12alpha,14beta,18-pentahydroxy-7alpha,20-epoxy-ent-kaur-16-en-15-one|parvifoline P
3,3-dimethoxyxanthocillin X dimethyl ether|3,3-dimethoxyxanthocillinX dimethyl ether
1beta-hydroxy-8-desacylzacatechinolide-(2-methyl butyrate)
methyl 3,5-di-O-(3-methyl-(E)-2-pentenoyl)shikimate
(1S,3R,6R,7R,8R,10R)-1-hydroxy-3-methoxy-3,10-epoxy-8-isobutyryloxygermacra-4,11(13)-dien-6,12-olide|TD-6
8alpha-Angeloyloxy-1beta,10alpha-epoxy-2alpha,15-dihydroxy-11betaH-germacr-4Z-en-12,6alpha-olide
8alpha-O-(4-hydroxy-2-methylenebutanoyloxy)-11beta,13-dihydrosonchucaprolide|8alpha-O-(4-hydroxy-2-methylenebutanoyloxy)-11beta,13-dihydrosonchucarpolide
6beta,7beta,11beta,14beta,18-pentahydroxy-7alpha,20-epoxy-ent-kaur-16-en-15-one|parvifoline O
2-methyl-3-buten-2-ol beta-D-apiofuranosyl-(1->6)-beta-D-glucopyranoside
2alpha-isovaleryloxy-3,8-dioxo-11-hydroxy-4beta,5beta,7alpha,14-bis-epoxybisabol-9E-ene
6beta-(angeloyloxy)-1-alpha,8beta,10beta-trihydroxyeremophil-7(11)-en-12,8alpha-olide|rel-(4S,4aS,5S,8S,8aS,9aS)-2,4,4a,5,6,7,8,8a,9,9a-decahydro-8,8a,9a-trihydroxy-3,4a,5-trimethyl-2-oxonaphtho[2,3-b]furan-4-yl (2Z)-2-methylbut-2-enoate
8beta-isovaleryloxy-3beta,10alpha-dihydroxy-1-oxo-germacra-4E,11(13)-diene-12,6alpha-olide
(1alpha,6beta,14beta)-7alpha,20-epoxy-1,7,14-trihydroxy-16-oxo-15,16-seco-ent-kauran-6,15-olide|Rubescensin S
7alpha,8alpha-epoxy-senatractolide-6-O-(2-methylbutyrate)
2-Hydroxy-3-methoxystrychnine
A monoterpenoid indole alkaloid with formula C22H24N2O4, originallly isolated from the seeds of Strychnos nux-vomica.
8alpha-angeloyloxy-2beta,4beta,10beta-trihydroxy-6betaH,7alphaH,11betaH-1(5)-guaien-12,6alpha-olide
4-hydroxy-19-methyl-16,19-seco-12,24-seco-strychnidine-10,16-dione
(Z)-3-hexenyl alpha-L-arabinopyranosyl-(1->6)-beta-D-glucopyranoside
1alpha-angeloyloxy-6beta,8beta,9beta-trihydroxyeremophil-7(11)-en-(12,8alpha)-olide|melanothyrsin C
(6R*)-11alpha,15alpha,16beta-trihydroxy-6,7-seco-3alpha,6:6,20-diepoxy-ent-kaur-1alpha,7-olide|jianshirubesin A
5beta,9beta-Dihydroxy-8beta-(isovaleryloxy)trichosalviolid
Cannagunin B|cannagunine-B|ent-(16Z)-18-hydroxy-1-methyl-19-nor-coryn-16-ene-5alpha,16-dicarboxylic acid 5-methyl ester 16-lactone|ent-1-methyl-18-oxo-19-oxa-19a-homo-yohimb-16-ene-5alpha-carboxylic acid methyl ester
(4S,4aS,5R,6S,8aS,9aR)-2,4,4a,5,6,7,8,8a,9,9a-decahydro-4,8a,9a-trihydroxy-3,4a,5-trimethyl-2-oxonaphtho[2,3-b]furan-6-yl (2E)-2-methylbut-2-enoate|6beta,8alpha,10beta-trihydroxy-3-[((E)-2-methylbut-2-enoyl)oxy]eremophilenolide|hertidin D
3alpha,10alpha,13alpha,16alpha,17-pentahydroxy-9alpha-methyl-15-oxo-20-nor-kauran-19-oic acid gamma-lactone|3??,10??,13??,16??,17-Pentahydroxy-9??-methyl-15-oxo-20-nor-kaur-an-19-oic acid ??-lactone
(4S,4aS,5R,6S,8aS,9aR)-2,4,4a,5,6,7,8,8a,9,9a-decahydro-4,8a,9a-trihydroxy-3,4a,5-trimethyl-2-oxonaphtho[2,3-b]furan-6-yl 3-methylbut-2-enoate|6beta,8alpha,10beta-trihydroxy-3-[(3-methylbut-2-enoyl)oxy]eremophilenolide|hertidin C
7alpha,8alpha-epoxy-senatractolide-6-O-isovalerate
12-hydroxy-16-methoxy-strychnidin-10-one|Desmethoxy-rindlin
12-hydroxy-11-methoxy-strychnine|12-hydroxy-11-methoxystrychnine|4-hydroxy-3-methoxy-strychnidin-10-one|4-hydroxy-3-methoxy-strychnine|4-Hydroxy-3-methoxystrychnin|4-hydroxy-3-methoxystrychnine|4-hydroxy-alpha-colubrine
2-alpha-hydroxyeudesma-4,11(13)-dien-12,8beta-olide-2-O-beta-D-xylopyranoside
methyl 4,5-di-O-(3-methyl-(E)-2-pentenoyl)shikimate
1??,7??,10??,13??-Tetrahydroxy-9??-methyl-15-oxo-20-nor-kauran-19-oic acid ??-lactone
9alpha-hydroxy-3Z-seco-ratiferolide-5alpha-O-(2-methylbutyrate)|9alpha-hydroxy-3Z-seco-ratiferolide-5alpha-O-<2-methylbutyrate>
2alpha,10alpha,13alpha,16alpha,17-pentahydroxy-9alpha-methyl-15-oxo-20-nor-kauran-19-oic acid (19,10)-lactone|2alpha,10alpha,13alpha,16alpha,17-pentahydroxy-9alpha-methyl-15-oxo-20-nor-kauran-19-oic acid gamma-lactone|2??,10??,13??,16??,17-Pentahydroxy-9??-methyl-15-oxo-20-nor-kauran-19-oic acid (19,10)-lactone
(5R,6R,7R,8S,10S,11S)-15-hydroxy-8-(1,2-dihydroxyethyl)-acryloxyelema-1,3-dien-6,12-olide
2,3,14-Triacetoxy-8,17-epoxy-9-hydroxy-5,11-briaradien-18,7-olide
2,2-Dimethyl-4-(acetoxymethyl)-5-(2-chloroethyl)-6-(butanoyloxymethyl)indan
14-Hydroxyicajine
A monoterpenoid indole alkaloid with formula C22H24N2O4, originallly isolated from the leaves of Strychnos icaja.
(16E,19S)-17,19-Epoxy-21-hydroxy-1-methyl-20alphaH-4,21-seco-coryna-3,5,16-trien-16-carbonsaeure-methylester|(16E,19S)-17,19-epoxy-21-hydroxy-1-methyl-20alphaH-4,21-seco-coryna-3,5,16-triene-16-carboxylic acid methyl ester|(4S)-5c-hydroxymethyl-6t-methyl-4r-(9-methyl-9H-beta-carbolin-1-ylmethyl)-5,6-dihydro-4H-pyran-3-carboxylic acid methyl ester|Alstonidin|alstonidine
1beta,3beta-Dihydroxy-6alpha-(2-hydroxymethylacryloyloxy)costic acid methyl ester
9alpha-hydroxy-seco-ratiferolide-5alpha-O-(2-methylbutyrate)
12-(3-(3,4-Dimethoxyphenyl)acryloyl)-cytisine
C20H28O7_2-Butenoic acid, 4-hydroxy-2-methyl-, (1R,5S,6S)-3-(hydroxymethyl)-6-(1-methylethyl)-5-[[(2Z)-2-methyl-1-oxo-2-buten-1-yl]oxy]-2-oxo-3-cyclohexen-1-yl ester, (2E)
C16H28O10_2-Methyl-3-buten-2-yl 6-O-[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydro-2-furanyl]-beta-D-glucopyranoside
[(1R,5S,6S)-3-(hydroxymethyl)-5-[(Z)-2-methylbut-2-enoyl]oxy-2-oxo-6-propan-2-ylcyclohex-3-en-1-yl] (E)-4-hydroxy-2-methylbut-2-enoate
(Z)-3-(4-hydroxyphenyl)-N-[4-[[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]amino]butyl]prop-2-enamide
Vomicine
Vomicine, an alkaloid, shows antidiabetic activity[1]. Vomicine, an alkaloid, shows antidiabetic activity[1].
CP-122721
CONFIDENCE standard compound; INTERNAL_ID 443; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8208; ORIGINAL_PRECURSOR_SCAN_NO 8206 CONFIDENCE standard compound; INTERNAL_ID 443; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8220; ORIGINAL_PRECURSOR_SCAN_NO 8218 CONFIDENCE standard compound; INTERNAL_ID 443; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8261; ORIGINAL_PRECURSOR_SCAN_NO 8260 CONFIDENCE standard compound; INTERNAL_ID 443; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8255; ORIGINAL_PRECURSOR_SCAN_NO 8254 CONFIDENCE standard compound; INTERNAL_ID 443; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8236; ORIGINAL_PRECURSOR_SCAN_NO 8233 CONFIDENCE standard compound; INTERNAL_ID 443; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8236; ORIGINAL_PRECURSOR_SCAN_NO 8233; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7 CONFIDENCE standard compound; INTERNAL_ID 443; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8260; ORIGINAL_PRECURSOR_SCAN_NO 8259
[(1R,5S,6S)-3-(hydroxymethyl)-5-[(Z)-2-methylbut-2-enoyl]oxy-2-oxo-6-propan-2-ylcyclohex-3-en-1-yl] (E)-4-hydroxy-2-methylbut-2-enoate_major
Ala Ala Gly Tyr
Ala Ala Tyr Gly
Ala Phe Gly Ser
Ala Phe Ser Gly
Ala Gly Ala Tyr
Ala Gly Phe Ser
Ala Gly His Pro
Ala Gly Pro His
Ala Gly Ser Phe
Ala Gly Tyr Ala
Ala His Gly Pro
Ala His Pro Gly
Ala Pro Gly His
Ala Pro His Gly
Ala Ser Phe Gly
Ala Ser Gly Phe
Ala Tyr Ala Gly
Ala Tyr Gly Ala
Phe Ala Gly Ser
Phe Ala Ser Gly
Phe Gly Ala Ser
Phe Gly Gly Thr
Phe Gly Ser Ala
Phe Gly Thr Gly
Phe Ser Ala Gly
Phe Ser Gly Ala
Phe Thr Gly Gly
Gly Ala Ala Tyr
Gly Ala Phe Ser
Gly Ala His Pro
Gly Ala Pro His
Gly Ala Ser Phe
Gly Ala Tyr Ala
Gly Phe Ala Ser
Gly Phe Gly Thr
Gly Phe Ser Ala
Gly Phe Thr Gly
Gly Gly Phe Thr
Gly Gly Thr Phe
Gly His Ala Pro
Gly His Pro Ala
Gly Pro Ala His
Gly Pro His Ala
Gly Ser Ala Phe
Gly Ser Phe Ala
Gly Thr Phe Gly
Gly Thr Gly Phe
Gly Tyr Ala Ala
His Ala Gly Pro
His Ala Pro Gly
His Gly Ala Pro
His Gly Pro Ala
His Pro Ala Gly
His Pro Gly Ala
Pro Ala Gly His
Pro Ala His Gly
Pro Gly Ala His
Pro Gly His Ala
Pro His Ala Gly
Pro His Gly Ala
Ser Ala Phe Gly
Ser Ala Gly Phe
Ser Phe Ala Gly
Ser Phe Gly Ala
Ser Gly Ala Phe
Ser Gly Phe Ala
Thr Phe Gly Gly
Thr Gly Phe Gly
Thr Gly Gly Phe
Tyr Ala Ala Gly
Tyr Ala Gly Ala
Tyr Gly Ala Ala
Pteroside B
3-Methyl-3-butenyl apiosyl-(1->6)-glucoside
Prenyl apiosyl-(1->6)-glucoside
Bis-coumaramidobutane
Cinncassiol C
Valepotriate a1
6b-Angeloyl-3b,8b,9b-trihydroxy-7(11)-eremophilen-12,8-olide
Prenyl arabinosyl-(1->6)-glucoside
benzyl 1-(2-hydroxy-2-methylpropyl)-5-methyl-3-oxo-2-phenylpyrazole-4-carboxylate
Cibenzoline succinate
C78274 - Agent Affecting Cardiovascular System > C47793 - Antiarrhythmic Agent D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents
7-[4-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]butoxy]-3,4-dihydro-1H-quinolin-2-one
2-[3-(3,4-DIHYDRO-6,7-DIMETHOXY-2(1H)-ISOQUINOLINYL)PROPYL]-1H-ISOINDOLE-1,3(2H)-DIONE
2,5-Furandione, polymer with 2,2-(1,2-ethanediylbis(oxy))bis(ethanol) and 3a,4,7,7a-tetrahydro-4,7-methano-1H-indene
Selitrectinib
C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C1967 - Tyrosine Kinase Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor > C155765 - TRK Inhibitor C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent D004791 - Enzyme Inhibitors
Benzoic acid, 4-(2-(5,6-dihydro-5,5-dimethyl-8-phenyl-2-naphthalenyl)ethenyl)-, (E)-
D020011 - Protective Agents > D000975 - Antioxidants > D002338 - Carotenoids
4-(1-Benzyl-3-carbamoylmethyl-2-methyl-1H-indol-5-yloxy)-butyric acid
(2S,3S)-1-[[2-Methoxy-5-(trifluoromethoxy)phenyl]methyl]-2-phenylpiperidin-3-amine
[(2S,3S,5R)-3-Azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl (2S,3S)-2-amino-3-methylpentanoate
(6E)-6-[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-ylidene]-2,5-bis(azaniumyl)hexanoate
4-[5-(4-ethoxyphenyl)-3-isoxazolyl]-N-(3-methoxyphenyl)butanamide
N-cyclohexyl-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-furancarboxamide
(4aS,6aS,12aS,12bR,12cS)-4a-hydroxy-15-methyl-4a,5,12,12a,12b,12c-hexahydro-11H-6a,4-(ethanoiminomethano)-1-oxa-10b-azacyclohepta[1,2,3-cd]fluoranthene-6,11(2H)-dione
(4aR,6aS,12aS,12bR,12cS,14S)-14-hydroxy-15-methyl-4a,5,12,12a,12b,12c-hexahydro-11H-6a,4-(ethanoiminomethano)-1-oxa-10b-azacyclohepta[1,2,3-cd]fluoranthene-6,11(2H)-dione
(4aR,6aS,12aS,12bR,12cS)-8-hydroxy-15-methyl-4a,5,12,12a,12b,12c-hexahydro-11H-6a,4-(ethanoiminomethano)-1-oxa-10b-azacyclohepta[1,2,3-cd]fluoranthene-6,11(2H)-dione
(4aR,6aS,12aS,12bR,12cS)-9-hydroxy-15-methyl-4a,5,12,12a,12b,12c-hexahydro-11H-6a,4-(ethanoiminomethano)-1-oxa-10b-azacyclohepta[1,2,3-cd]fluoranthene-6,11(2H)-dione
3-fluoro-N-[(2S,3R,6R)-2-(hydroxymethyl)-6-[2-(4-morpholinyl)-2-oxoethyl]-3-oxanyl]benzamide
3-fluoro-N-[(2R,3R,6R)-2-(hydroxymethyl)-6-[2-(4-morpholinyl)-2-oxoethyl]-3-oxanyl]benzamide
3-fluoro-N-[(2S,3S,6R)-2-(hydroxymethyl)-6-[2-(4-morpholinyl)-2-oxoethyl]-3-oxanyl]benzamide
1-[(2S,3R)-6-benzoyl-2-(hydroxymethyl)-3-phenyl-1,6-diazaspiro[3.3]heptan-1-yl]-2-methoxyethanone
1-[(2R,3R)-6-benzoyl-2-(hydroxymethyl)-3-phenyl-1,6-diazaspiro[3.3]heptan-1-yl]-2-methoxyethanone
3-fluoro-N-[(2S,3R,6S)-2-(hydroxymethyl)-6-[2-(4-morpholinyl)-2-oxoethyl]-3-oxanyl]benzamide
3-fluoro-N-[(2R,3S,6S)-2-(hydroxymethyl)-6-[2-(4-morpholinyl)-2-oxoethyl]-3-oxanyl]benzamide
3-fluoro-N-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-(4-morpholinyl)-2-oxoethyl]-3-oxanyl]benzamide
3-fluoro-N-[(2R,3R,6S)-2-(hydroxymethyl)-6-[2-(4-morpholinyl)-2-oxoethyl]-3-oxanyl]benzamide
1-[(2S,3S)-6-benzoyl-2-(hydroxymethyl)-3-phenyl-1,6-diazaspiro[3.3]heptan-1-yl]-2-methoxyethanone
Methyl (1R,4S,12S,13S,16R,18S)-18-hydroxy-17-oxo-5,14-diazaheptacyclo[12.5.3.01,13.04,12.04,18.06,11.012,16]docosa-6,8,10-triene-5-carboxylate
2-[(9-Ethyl-3-carbazolyl)iminomethyl]propanedioic acid diethyl ester
6-[(2Z)-2-benzylideneheptoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
1,1-Dimethyl-2-propenyl 6-O-[[(2R)-3alpha,4alpha-dihydroxy-4-(hydroxymethyl)tetrahydrofuran]-2beta-yl]-beta-D-glucopyranoside
(9S)-11-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one
[1-Acetyloxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl] pentanoate
[1-Propanoyloxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl] butanoate
4-O-acetyl-2,3-di-O-methyl-alpha-L-fucopyranosyl-(1->3)-alpha-L-rhamnopyranose
A glycosylrhamnose derivative consisting of alpha-L-rhamnopyranose having a 4-O-acetyl-2,3-di-O-methyl-alpha-L-galactopyranosyl residue attached at the 3-position.
10-hydroxyicajine
A monoterpenoid indole alkaloid with formula C22H24N2O4, originallly isolated from the seeds of Strychnos nux-vomica.
11-hydroxyicajine
A monoterpenoid indole alkaloid with formula C22H24N2O4, originallly isolated from the seeds of Strychnos nux-vomica.
5-hydroxyvomicine
A monoterpenoid indole alkaloid with formula C22H24N2O4, originallly isolated from the seeds of Strychnos nux-vomica.
(1r,2r,4s,5r,6s,9s,10s,11s,13r,14s)-2-hydroxy-2,6,11-trimethyl-7-oxo-8,12,15-trioxapentacyclo[8.5.0.0¹,¹⁴.0⁵,⁹.0¹¹,¹³]pentadecan-4-yl 3-methylbutanoate
7-(but-2-enoyl)-5,7-dihydroxy-6-methyl-3-methylidene-2-oxo-hexahydrocyclohepta[b]furan-8-yl 2-methylbutanoate
10-hydroperoxy-6,15a-dihydroxy-3,6,10,14-tetramethyl-7h,11h,12h,13h,14h-cyclotetradeca[b]furan-2,15-dione
(1s,12r,13r,18r)-17-acetyl-6-methoxy-3,20-dimethyl-15-oxa-3,20-diazapentacyclo[10.7.1.0²,¹⁰.0⁴,⁹.0¹³,¹⁸]icosa-2(10),4,6,8,16-pentaen-11-one
(3r,3as,5r,6s,7s,8s,8ar)-7-[(2e)-but-2-enoyl]-5,7-dihydroxy-3,6-dimethyl-2-oxo-hexahydro-3h-cyclohepta[b]furan-8-yl (2e)-2-methylbut-2-enoate
5,6-dihydroxy-6,10-dimethyl-3-methylidene-2,7-dioxo-3ah,4h,5h,8h,11h,11ah-cyclodeca[b]furan-4-yl 3-methylbutanoate
1,12-dihydroxy-2-(hydroxymethyl)-11-methyl-9-[(2-methylbut-2-en-1-yl)oxy]-7-methylidene-5,14-dioxatricyclo[9.2.1.0⁴,⁸]tetradec-2-en-6-one
17-methoxy-9-oxa-4,13-diazahexacyclo[9.8.3.2¹⁰,¹³.0¹,¹².0⁶,²².0¹⁴,¹⁹]tetracosa-6,14,16,18-tetraene-20,23-dione
5,6-dihydroxy-6,10-dimethyl-3-methylidene-2,7-dioxo-3ah,4h,5h,10h,11h,11ah-cyclodeca[b]furan-4-yl 3-methylbutanoate
6-(2-hydroxyethyl)-2,2,5,7-tetramethyl-3-[(3,4,5-trihydroxyoxan-2-yl)oxy]-3h-inden-1-one
6-methoxy-3,16,20-trimethyl-11-oxo-15-oxa-3,20-diazapentacyclo[10.7.1.0²,¹⁰.0⁴,⁹.0¹³,¹⁸]icosa-2(10),4,6,8,16-pentaene-17-carbaldehyde
(3r)-6-(2-hydroxyethyl)-2,2,5,7-tetramethyl-3-{[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}-3h-inden-1-one
(1r,2s,3s,7s,9r,13s,14r,15r,16r,17s)-3,15,16-trihydroxy-17-(hydroxymethyl)-2,6,14-trimethyl-10-oxatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadec-5-ene-4,11-dione
(3as,4r,10s,11ar)-6-(hydroxymethyl)-10-methyl-3-methylidene-2-oxo-3ah,4h,7h,8h,9h,10h,11h,11ah-cyclodeca[b]furan-4-yl (2e)-4-hydroxy-2-(hydroxymethyl)but-2-enoate
8,9-dihydroxy-4,9-dimethyl-14-methylidene-13-oxo-5,12-dioxatricyclo[9.3.0.0⁴,⁶]tetradecan-2-yl 2-methylbut-2-enoate
(1s,2z,4r,8r,9r,11s)-1-hydroxy-2-(hydroxymethyl)-11-methyl-7-methylidene-6-oxo-5,14-dioxatricyclo[9.2.1.0⁴,⁸]tetradec-2-en-9-yl (2r)-2-methylbutanoate
(2r,3r,4s,5s,6r)-2-[(3-methylbut-3-en-1-yl)oxy]-6-({[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}methyl)oxane-3,4,5-triol
(1s,2s,5s,8r,9s,10s,11r,15s,16r,18r)-9,10,15,16,18-pentahydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecan-7-one
(4s,4as,5r,6s,8as,9ar)-4,8a,9a-trihydroxy-3,4a,5-trimethyl-2-oxo-4h,5h,6h,7h,8h,9h-naphtho[2,3-b]furan-6-yl (2e)-2-methylbut-2-enoate
(1s,2z,4r,8r,9r,11r)-1-hydroxy-2-(hydroxymethyl)-11-methyl-7-methylidene-6-oxo-5,14-dioxatricyclo[9.2.1.0⁴,⁸]tetradec-2-en-9-yl (2r)-2-methylbutanoate
methyl (10z)-10-ethylidene-13-oxo-6-oxa-8,15-diazapentacyclo[12.7.0.0³,⁸.0⁴,¹¹.0¹⁶,²¹]henicosa-1(14),16,18,20-tetraene-4-carboxylate
(2r,3r,4s,5s,6r)-2-[(3-methylbut-2-en-1-yl)oxy]-6-({[(2r,3r,4r,5r)-3,4,5-trihydroxyoxan-2-yl]oxy}methyl)oxane-3,4,5-triol
6-hydroxy-5a-methyl-3,9-dimethylidene-2-oxo-octahydronaphtho[1,2-b]furan-4-yl 2,3-dihydroxy-2-methylbutanoate
(1s,2r,4s,6r,8s,9s,11r)-8,9-dihydroxy-4,9-dimethyl-14-methylidene-13-oxo-5,12-dioxatricyclo[9.3.0.0⁴,⁶]tetradecan-2-yl (2z)-2-methylbut-2-enoate
(1r,2s,4s,5r,8r,9s,10s,11r,12s,18r)-4,9,10,18-tetrahydroxy-12-(hydroxymethyl)-12-methyl-6-methylidene-17-oxapentacyclo[7.6.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecan-7-one
6,9,17-trihydroxy-7,7,17-trimethyl-3,10-dioxapentacyclo[14.2.1.0¹,¹³.0⁴,¹².0⁸,¹²]nonadecane-2,18-dione
6,9,9a-trihydroxy-3,4a,5-trimethyl-2-oxo-4h,5h,6h,7h,8h,8ah,9h-naphtho[2,3-b]furan-4-yl 2-methylbut-2-enoate
(1s,10s,11r,12s,22s)-22-hydroxy-4-methyl-9-oxa-4,13-diazahexacyclo[9.8.3.2¹⁰,¹³.0¹,¹².0⁶,²².0¹⁴,¹⁹]tetracosa-6,14,16,18-tetraene-20,23-dione
5,6,13-trihydroxy-6-(hydroxymethyl)-2,12-dimethyl-16-oxapentacyclo[10.3.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecane-7,17-dione
(2r,2's)-7,7'-dimethoxy-2,2',4,4'-tetramethyl-1h,1'h-[2,2'-biindole]-3,3'-dione
6,9a-dihydroxy-3,5a-dimethyl-9-methylidene-2-oxo-octahydronaphtho[1,2-b]furan-4-yl 3-hydroxy-2-methylidenebutanoate
8,8a,9a-trihydroxy-3,4a,5-trimethyl-2-oxo-4h,5h,6h,7h,8h,9h-naphtho[2,3-b]furan-4-yl 2-methylbut-2-enoate
(2r,3s,4s,5r,6r)-2-(hydroxymethyl)-6-{[(4e,6r,12e)-1-hydroxytetradeca-4,12-dien-8,10-diyn-6-yl]oxy}oxane-3,4,5-triol
(3s,3ar,4s,5ar,6r,9s,9as,9br)-9-formyl-6-hydroxy-3,5a-dimethyl-2-oxo-decahydronaphtho[1,2-b]furan-4-yl 4-hydroxy-2-methylidenebutanoate
11-dehydroklaineanone
{"Ingredient_id": "HBIN000385","Ingredient_name": "11-dehydroklaineanone","Alias": "NA","Ingredient_formula": "C20H28O7","Ingredient_Smile": "CC1C(C(C2C3(C(CC4C2(C1(CC(=O)O4)O)C)C(=CC(=O)C3O)C)C)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "4937","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
15β-hydroxyklaineanone
{"Ingredient_id": "HBIN001629","Ingredient_name": "15\u03b2-hydroxyklaineanone","Alias": "NA","Ingredient_formula": "C20H28O7","Ingredient_Smile": "CC1C2C(C(=O)OC3C2(C(C(C1O)O)C4(C(C3)C(=CC(=O)C4O)C)C)C)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10289","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
16-hydroxy-α-colubrine
{"Ingredient_id": "HBIN001910","Ingredient_name": "16-hydroxy-\u03b1-colubrine","Alias": "NA","Ingredient_formula": "C22H24N2O4","Ingredient_Smile": "COC1=CC2=C(C=C1)C34CCN5C3(CC6C7C4N2C(=O)CC7OCC=C6C5)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT15824","TCMID_id": "9929","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
16-hydroxy-β-colubrine
{"Ingredient_id": "HBIN001913","Ingredient_name": "16-hydroxy-\u03b2-colubrine","Alias": "NA","Ingredient_formula": "C22H24N2O4","Ingredient_Smile": "COC1=CC2=C(C=C1)N3C4C25CCN6C5(CC7C4C(CC3=O)OCC=C7C6)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT15825","TCMID_id": "9930","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
16-Hydroxycolubrine (beta)
{"Ingredient_id": "HBIN001914","Ingredient_name": "16-Hydroxycolubrine (beta)","Alias": "16-hydroxycolubrine(beta)","Ingredient_formula": "C22H24N2O4","Ingredient_Smile": "COC1=CC2=C(C=C1)N3C4C25CCN6C5(CC7C4C(CC3=O)OCC=C7C6)O","Ingredient_weight": "380.48","OB_score": "7.815810121","CAS_id": "NA","SymMap_id": "SMIT01086","TCMID_id": "31170","TCMSP_id": "MOL003408","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2,3-didehydrocinnzeylanone
{"Ingredient_id": "HBIN003966","Ingredient_name": "2,3-didehydrocinnzeylanone","Alias": "NA","Ingredient_formula": "C20H28O7","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5464","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(2R)- pterosin B 14- O- β-glucopyranoside
{"Ingredient_id": "HBIN006554","Ingredient_name": "(2R)- pterosin B 14- O- \u03b2-glucopyranoside","Alias": "NA","Ingredient_formula": "C20H28O7","Ingredient_Smile": "CC1CC2=CC(=C(C(=C2C1=O)C)CCOC3C(C(C(C(O3)CO)O)O)O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "35773","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(2s)-pteroside b
{"Ingredient_id": "HBIN006824","Ingredient_name": "(2s)-pteroside b","Alias": "NA","Ingredient_formula": "C20H28O7","Ingredient_Smile": "CC1CC2=CC(=C(C(=C2C1=O)C)CCOC3C(C(C(C(O3)CO)O)O)O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "18103","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3-oxo-11-methoxytabersonine
{"Ingredient_id": "HBIN009396","Ingredient_name": "3-oxo-11-methoxytabersonine","Alias": "NA","Ingredient_formula": "C22H24N2O4","Ingredient_Smile": "CCC12CC(=C3C4(C1N(CC4)C(=O)C=C2)C5=C(N3)C=C(C=C5)OC)C(=O)OC","Ingredient_weight": "380.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "16368","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "128165","DrugBank_id": "NA"}
4-hydroxy-1-naphthalenyl-β-d-glucopyranoside
{"Ingredient_id": "HBIN010428","Ingredient_name": "4-hydroxy-1-naphthalenyl-\u03b2-d-glucopyranoside","Alias": "NA","Ingredient_formula": "C20H28O7","Ingredient_Smile": "CC1=C2CC(CCC2=CC(=C1OC3C(C(C(C(O3)CO)O)O)O)O)C(=C)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10535","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
4-Hydroxy-3-methoxystrychnine
{"Ingredient_id": "HBIN010482","Ingredient_name": "4-Hydroxy-3-methoxystrychnine","Alias": "4-hydroxy-3-methoxystrychnine","Ingredient_formula": "C22H24N2O4","Ingredient_Smile": "COC1=C(C2=C(C=C1)C34CCN5C3CC(C(=CCO)C5)C6=CCC(=O)N2C46)O","Ingredient_weight": "380.48","OB_score": "20.92618209","CAS_id": "NA","SymMap_id": "SMIT01040","TCMID_id": "10458","TCMSP_id": "MOL003434","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
6-oxoalstophyllal
{"Ingredient_id": "HBIN012733","Ingredient_name": "6-oxoalstophyllal","Alias": "NA","Ingredient_formula": "C22H24N2O4","Ingredient_Smile": "CC1=C(C2CC3C4=C(C5=C(N4C)C=C(C=C5)OC)C(=O)C(C2CO1)N3C)C=O","Ingredient_weight": "380.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "16281","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "101730882","DrugBank_id": "NA"}
6-oxoalstophylline
{"Ingredient_id": "HBIN012734","Ingredient_name": "6-oxoalstophylline","Alias": "NA","Ingredient_formula": "C22H24N2O4","Ingredient_Smile": "CC(=O)C1=COCC2C1CC3C4=C(C5=C(N4C)C=C(C=C5)OC)C(=O)C2N3C","Ingredient_weight": "380.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "16282","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "101730883","DrugBank_id": "NA"}
8α-angeloxy-2α,4α,10β-trihydroxy-6βh,7αh,11βh-1(5)-guaien-12,6α-olide
{"Ingredient_id": "HBIN013621","Ingredient_name": "8\u03b1-angeloxy-2\u03b1,4\u03b1,10\u03b2-trihydroxy-6\u03b2h,7\u03b1h,11\u03b2h-1(5)-guaien-12,6\u03b1-olide","Alias": "NA","Ingredient_formula": "C20H28O7","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1203","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}