Exact Mass: 374.1760952
Exact Mass Matches: 374.1760952
Found 500 metabolites which its exact mass value is equals to given mass value 374.1760952
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Hexahydrocurcumin
Hexahydrocurcumin is a member of the class of compounds known as curcuminoids. Curcuminoids are aromatic compounds containing a curcumin moiety, which is composed of two aryl buten-2-one (feruloyl) chromophores joined by a methylene group. Hexahydrocurcumin is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Hexahydrocurcumin can be found in ginger, which makes hexahydrocurcumin a potential biomarker for the consumption of this food product. Hexahydrocurcumin is a diarylheptanoid. Hexahydrocurcumin is a natural product found in Zingiber officinale with data available. [Raw Data] CBA88_Hexahydrocurcum_pos_40eV.txt [Raw Data] CBA88_Hexahydrocurcum_neg_20eV.txt [Raw Data] CBA88_Hexahydrocurcum_pos_10eV.txt [Raw Data] CBA88_Hexahydrocurcum_neg_10eV.txt [Raw Data] CBA88_Hexahydrocurcum_pos_20eV.txt [Raw Data] CBA88_Hexahydrocurcum_pos_50eV.txt [Raw Data] CBA88_Hexahydrocurcum_neg_40eV.txt [Raw Data] CBA88_Hexahydrocurcum_neg_30eV.txt [Raw Data] CBA88_Hexahydrocurcum_neg_50eV.txt [Raw Data] CBA88_Hexahydrocurcum_pos_30eV.txt Hexahydrocurcumin is one of the major metabolites of curcumin and a selective, orally active COX-2 inhibitor. Hexahydrocurcumin is inactive against COX-1. Hexahydrocurcumin has antioxidant, anticancer and anti-inflammatory activities[1][2]. Hexahydrocurcumin is one of the major metabolites of curcumin and a selective, orally active COX-2 inhibitor. Hexahydrocurcumin is inactive against COX-1. Hexahydrocurcumin has antioxidant, anticancer and anti-inflammatory activities[1][2].
Hydroxyzine
A histamine H1 receptor antagonist that is effective in the treatment of chronic urticaria, dermatitis, and histamine-mediated pruritus. Unlike its major metabolite cetirizine, it does cause drowsiness. It is also effective as an antiemetic, for relief of anxiety and tension, and as a sedative. [PubChem] CONFIDENCE standard compound; INTERNAL_ID 1306; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8146; ORIGINAL_PRECURSOR_SCAN_NO 8142 CONFIDENCE standard compound; INTERNAL_ID 1306; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8167; ORIGINAL_PRECURSOR_SCAN_NO 8166 CONFIDENCE standard compound; INTERNAL_ID 1306; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8152; ORIGINAL_PRECURSOR_SCAN_NO 8147 CONFIDENCE standard compound; INTERNAL_ID 1306; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8169; ORIGINAL_PRECURSOR_SCAN_NO 8167 CONFIDENCE standard compound; INTERNAL_ID 1306; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8128; ORIGINAL_PRECURSOR_SCAN_NO 8124 CONFIDENCE standard compound; INTERNAL_ID 1306; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8120; ORIGINAL_PRECURSOR_SCAN_NO 8118 N - Nervous system > N05 - Psycholeptics > N05B - Anxiolytics > N05BB - Diphenylmethane derivatives D018377 - Neurotransmitter Agents > D018494 - Histamine Agents > D006633 - Histamine Antagonists C308 - Immunotherapeutic Agent > C29578 - Histamine-1 Receptor Antagonist D003879 - Dermatologic Agents > D000982 - Antipruritics Hydroxyzine, a benzodiazepine antihistamine agent, acts as an orally active histamine?H1-receptor and serotonin antagonist. Hydroxyzine has anxiolytic effect and can be used for the research of generalised anxiety disorder[1].
Phantomolin
A germacranolide isolated from Elephantopus mollis and has been shown to exhibit antineoplastic activity.
2-(4-Allyl-2,6-dimethoxyphenoxy)-1-(4-hydroxy-3-methoxyphenyl)-1-propanol
2-(4-Allyl-2,6-dimethoxyphenoxy)-1-(4-hydroxy-3-methoxyphenyl)-1-propanol is found in herbs and spices. 2-(4-Allyl-2,6-dimethoxyphenoxy)-1-(4-hydroxy-3-methoxyphenyl)-1-propanol is from seed kernels of Myristica fragrans (nutmeg). From seed kernels of Myristica fragrans (nutmeg). 2-(4-Allyl-2,6-dimethoxyphenoxy)-1-(4-hydroxy-3-methoxyphenyl)-1-propanol is found in herbs and spices. 2-(4-Allyl-2,6-dimethoxyphenoxy)-1-(4-hydroxy-3-methoxyphenyl)-1-propanol is a phenylpropanoid.
Fragransol A
Fragransol A is found in herbs and spices. Fragransol A is a constituent of Myristica fragrans (nutmeg). Constituent of Myristica fragrans (nutmeg). Fragransol A is found in nutmeg and herbs and spices.
Fragransin C1
Fragransin C2 is found in herbs and spices. Fragransin C2 is isolated from Myristica fragrans (nutmeg). Isolated from Myristica fragrans (nutmeg). Fragransin C1 is found in nutmeg and herbs and spices.
Sonchifolin
Sonchifolin is found in green vegetables. Sonchifolin is a constituent of Smallanthus sonchifolius (yacon). Constituent of Smallanthus sonchifolius (yacon). Sonchifolin is found in green vegetables.
1-(4-Hydroxy-3,5-dimethoxyphenyl)-2-[2-methoxy-4-(1-propenyl)phenoxy]-1-propanol
1-(4-Hydroxy-3,5-dimethoxyphenyl)-2-[2-methoxy-4-(1-propenyl)phenoxy]-1-propanol is found in herbs and spices. 1-(4-Hydroxy-3,5-dimethoxyphenyl)-2-[2-methoxy-4-(1-propenyl)phenoxy]-1-propanol is a constituent of Myristica fragrans (nutmeg) oil. Constituent of Myristica fragrans (nutmeg) oil. 1-(4-Hydroxy-3,5-dimethoxyphenyl)-2-[2-methoxy-4-(1-propenyl)phenoxy]-1-propanol is found in herbs and spices.
Mammea B/BC cyclo E
Mammea B/BC cyclo E is found in fruits. Mammea B/BC cyclo E is a constituent of Mammea americana (mamey)
8,9-Dihydro-5-hydroxy-8-(1-hydroxy-1-methylethyl)-6-(1-oxobutyl)-4-propyl-2H-furo[2,3-h]-1-benzopyran-2-one
8,9-Dihydro-5-hydroxy-8-(1-hydroxy-1-methylethyl)-6-(1-oxobutyl)-4-propyl-2H-furo[2,3-h]-1-benzopyran-2-one is found in fruits. 8,9-Dihydro-5-hydroxy-8-(1-hydroxy-1-methylethyl)-6-(1-oxobutyl)-4-propyl-2H-furo[2,3-h]-1-benzopyran-2-one is a constituent of Mammea americana (mamey)
Cyclonormammein
Cyclonormammein is found in fruits. Cyclonormammein is a constituent of Mammea americana (mamey)
Myrislignan
Myrislignan is a natural product found in Myristica fragrans with data available. Myrislignan, a lignan isolated from Myristica fragrans Houtt, possesses anti-inflammatory activities. Myrislignan attenuates LPS-induced inflammation reaction in murine macrophage cells through inhibition of NF-kB signalling pathway activation[1]. Myrislignan, a lignan isolated from Myristica fragrans Houtt, possesses anti-inflammatory activities. Myrislignan attenuates LPS-induced inflammation reaction in murine macrophage cells through inhibition of NF-kB signalling pathway activation[1].
[1aR-(1aalpha,3alpha,4beta,4abeta,5beta,9aS*)]- 5-(Acetyloxy)-1a,2,4,4a,5,9-hexahydro-4,4a,6-trimethyl-3H-oxireno[8,8a]naphtho[2,3-b]furan-3-yl ester 2-methyl-2-propenoic acid
(E,E)-2-Methyl-4-methoxy-5-methyl-2-[2-[[(2-methyl-1-oxo-2-butenyl)oxy]methyl]oxiranyl]phenyl ester
2-(4-Allyl-2,6-dimethoxyphenoxy)-1-(3-hydroxy-5-methoxyphenyl)-1-propanol
Methyl (2S,4aS,6aR,7R,10aR,10bR)-2-(3-furyl)-7-hydroxy-6a,10b-dimethyl-4-oxo-1,4,4a,5,6,6a,7,10,10a,10b-decahydro-2H-benzo[f]isochromene-7-carboxylate
1-(3-fluoropentyl)-N-(naphthalen-1-yl)-1H-indole-3-carboxamide
C24H23FN2O (374.17943199999996)
1-(2-fluoropentyl)-N-(naphthalen-1-yl)-1H-indole-3-carboxamide
C24H23FN2O (374.17943199999996)
9alpha-hydroxy-6beta-(6-oxohex-2E,4E-dienoyloxy)-5alpha-drim-7-en-11,12-olide|ustusolate E
rel-(7R,8S,1R,2R,3S,4S)-Delta8-2,4-dihydroxy-3,5-dimethoxy-3,4-methylenedioxy-1,2,3,4-tetrahydro-7.3,8.1-neolignan
Tinophyllol
Tinophyllol is a natural product found in Penianthus zenkeri and Arcangelisia flava with data available.
3-Methoxy-2[[[3-(4-Methoxyphenyl)-2-propenyl]oxy]carbonyl]-2-butenyl 2-methyl-2-butenoate, 9CI|morinin L
(-)-(2R,3R)-2-(3,4-methylenedioxybenzyl)-3-(3,4-dimethoxybenzyl)butanediol|(-)-dihydro-3,4-dimethoxy-3,4-dimethylenedioxycubebin|(-)-dihydro-3,4-dimethoxy-3,4-demethylenedioxycubebin|(2R,3R)-2-(3,4-dimethoxybenzyl)-3-(3,4-methylenedioxybenzyl)-1,4-butanediol|2,3-desmethoxy seco-isolintetralin
Me ether-12-Hydroxy-6,11,14-trioxo-8,12-abietadien-18-oic acid
(2S,3S,1S,2R)-and(2S,3S,1R,2R)-2,3-Dihydro-5-(1,2-dihydroxypropyl)-2-(3,4-dimethoxyphenyl)-7-methoxy-3-methylbenzofuran|machilusol D
(8R*,9S*)-16,17-dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,8,9,15-tetrol|myricananin G
11,14-dihydroxy-12-methoxy-7-oxo-8,11,13-abietatrien-19-20beta-olide|19,20-epoxy-8-methyl-2-(1-methylethyl)-1,4-dihydroxy-3-methoxy-4b,5,6,7,8,8a,9,10-octahydro-phenanthren-10,19-dione
6beta-(2xi-methylbutyryloxy)eremophil-3,7(11),8-trien-8,12-olide-15-oic acid methyl ester
(-)-5,7-dihydroxy-4-(1S-hydroxypropyl)-6-(1-oxobutyl)-8-(3-methylbut-2-enyl)-2H-benzopyran-2-one|kayeassamin E
2beta-methoxy-2-deethoxy-8-O-deacylphantomolin-8-O-tiglinate
A germacranolide isolated from Elephantopus mollis and has been shown to exhibit antineoplastic activity.
5,3,4-trimethoxy-4,9-dihydroxy-2,8,9.O.7-neolignan
(-)-(7R,8R,8R)-4,4-dihydroxy-3,3,5-trimethoxy-7,9-epoxylignan
A lignan that is 3-methyloxolane substituted by a 4-hydroxy-3-methoxyphenyl group at position 5 and a (4-hydroxy-3,5-dimethoxyphenyl)methyl group at position 3. It has been isolated from the bark of Machilus robusta.
2beta,3alpha-dihydroxy-2,3,7,8alpha-tetrahydropenianthic acid-2,17-lactone
7-(3,4-Dihydroxyphenyl)-1-(3,5-dimethoxy-4-hydroxyphenyl)heptane-3-one
1-(4-Hydroxyphenyl)-3-acetoxy-5-hydroxy-7-(3,4-dihydroxyphenyl)heptane
(8S,8?R)-7?-(2-hydroxy-4,5-dimethoxyphenyl)-7-(2-methoxy-4,5-methylenedioxyphenyl)-8,8?-dimethylbutane|saurulignan C
(10R,16R)-12,16-epoxy-11,14,17-trihydroxy-6-methoxy-17(15?16)-abieta-5,8,11,13-tetraene-7-one|12,16-epoxy-11,14,17-trihydroxy-6-methoxy-17(15?16)-abeo-abieta-5,8,11,13-tetraene-7-one|18-hydroxy-6-methoxyvillosin C
(8S,8?R)-7?-(5-hydroxy-2,4-dimethoxyphenyl)-7-(2-methoxy-4,5-methylenedioxyphenyl)-8,8?-dimethylbutane|saurulignan D
(1S,3R,5S)-1,7-bis(4-hydroxy-3-methoxyphenyl)-1,5-epoxy-3-hydroxyheptane|diosniponol A
(1R,5S,6S)-1,5-epoxy-6-hydroxy-1,7-bis(3-methoxy-4-hydroxyphenyl)heptane|kravanhol B
cordato-oblongic acid methyl ester|Cordato-oblongic acid methylester|Cordato-oblonginsaeure-methylester
(2R,2S,3R,4bS,7R,8aS,9S,10S)-10-Formyloxy-4b,5,6,7,8,8a,9,10-octahydro-3,9-dihydroxy-2,4b,7-trimethyl-8-methylidenspiro(cyclopropan-1,2(1H)-phenanthren)-1,4(3H)-dion|(2R,2S,3R,4bS,7R,8aS,9S,10S)-10-Formyloxy-4b,5,6,7,8,8a,9,10-octahydro-3,9-dihydroxy-2,4b,7-trimethyl-8-methylidenspiro-1,4(3H)-dion
(8beta,7beta,8alpha)-4,4,5-trihydroxy-3,5,3-trimethoxy-2,7-cyclolignan|ocholignan B
(2S,4aS,6aR,7R,10aS,10bR)-2-(furan-3-yl)dodecahydro-6a,10b-dimethyl-4,10-dioxo-2H-naphtho[2,1-c]pyran-7-carboxylic acid methyl ester|(2S,4aS,6aR,7R,9S,10aS,10bR)-2-(3-furanyl)-dodecahydro-6a,10b-dimethyl-4,10-dioxo-2H-naphtho[2,1-c]-pyran-7-carboxylic acid methyl ester|2-deacetoxy-8-epi-salvinorin A
5,7-dihydroxy-4-(1-hydroxypropyl)-6-(3-methylbut-2-enyl)-8-(1-oxobutyl)-2H-benzopyran-2-one|theraphin A
methyl-3-prenyl-4-O-(beta-acetoxybutyryl)-coumarate
(7S,8R,1S,2S,3R)-Delta8-3,5-dimethoxy-2-hydroxy-3,4-methylenedioxy-1,2,3,4-tetrahydro-4-oxo-7.3,8.1-neolignan
(7S,8R,1S,3S,4S)-Delta8-4,4-dihydroxy-3,3,5-trimethoxy-1,2,3,4-tetrahydro-2-oxo-7.3,8.1-neolignan
1,7-bis(3,4-dihydroxyphenyl)heptan-3-yl acetate
1-[4-[2-(7-methoxy-1,3-benzodioxol-5-yl)ethyl]phenoxy]-3-methylbutane-2,3-diol
C21H26O6_(2S,3R,3aS,7aR)-5-Allyl-2-(4-hydroxy-3-methoxyphenyl)-3a,7a-dimethoxy-3-methyl-3,3a,7,7a-tetrahydro-1-benzofuran-6(2H)-one
C21H26O6_2H-Naphtho[2,1-c]pyran-7-carboxylic acid, 2-(3-furanyl)-1,4,4a,5,6,6a,7,10,10a,10b-decahydro-7-hydroxy-6a,10b-dimethyl-4-oxo-, methyl ester, (2S,4aS,6aR,7R,10aR,10bR)
C21H26O6_2,4-Hexadienoic acid, 6-oxo-, 1,3,5,5a,6,7,8,9,9a,9b-decahydro-9b-hydroxy-6,6,9a-trimethyl-1-oxonaphtho[1,2-c]furan-5-yl ester, (2E,4E)
C21H26O6_Benzenemethanol, alpha-[1-[2,6-dimethoxy-4-(2-propen-1-yl)phenoxy]ethyl]-4-hydroxy-3-methoxy
C21H26O6_2-[6-Acetyl-3-(isobutyryloxy)-2,3-dihydro-1-benzofuran-2-yl]-2-propen-1-yl 2-methylpropanoate
1-[4-[2-(7-methoxy-1,3-benzodioxol-5-yl)ethyl]phenoxy]-3-methylbutane-2,3-diol
4-[2-(2,6-dimethoxy-4-prop-2-enylphenoxy)-1-hydroxypropyl]-2-methoxyphenol
methyl (2S,4aS,6aR,7R,10aR,10bR)-2-(furan-3-yl)-7-hydroxy-6a,10b-dimethyl-4-oxo-2,4a,5,6,10,10a-hexahydro-1H-benzo[f]isochromene-7-carboxylate
2-[6-acetyl-3-(2-methylpropanoyloxy)-2,3-dihydro-1-benzofuran-2-yl]prop-2-enyl 2-methylpropanoate
hydroxyzine
N - Nervous system > N05 - Psycholeptics > N05B - Anxiolytics > N05BB - Diphenylmethane derivatives D018377 - Neurotransmitter Agents > D018494 - Histamine Agents > D006633 - Histamine Antagonists C308 - Immunotherapeutic Agent > C29578 - Histamine-1 Receptor Antagonist D003879 - Dermatologic Agents > D000982 - Antipruritics Hydroxyzine, a benzodiazepine antihistamine agent, acts as an orally active histamine?H1-receptor and serotonin antagonist. Hydroxyzine has anxiolytic effect and can be used for the research of generalised anxiety disorder[1].
1-[4-[2-(7-methoxy-1,3-benzodioxol-5-yl)ethyl]phenoxy]-3-methylbutane-2,3-diol [IIN-based on: CCMSLIB00000847813]
1-[4-[2-(7-methoxy-1,3-benzodioxol-5-yl)ethyl]phenoxy]-3-methylbutane-2,3-diol [IIN-based: Match]
1,7-bis(3,4-dihydroxyphenyl)heptan-3-yl acetate_major
methyl (2S,4aS,6aR,7R,10aR,10bR)-2-(furan-3-yl)-7-hydroxy-6a,10b-dimethyl-4-oxo-2,4a,5,6,10,10a-hexahydro-1H-benzo[f]isochromene-7-carboxylate_major
4-[2-(2,6-dimethoxy-4-prop-2-enylphenoxy)-1-hydroxypropyl]-2-methoxyphenol_major
2-[6-acetyl-3-(2-methylpropanoyloxy)-2,3-dihydro-1-benzofuran-2-yl]prop-2-enyl 2-methylpropanoate_major
1-[4-[2-(7-methoxy-1,3-benzodioxol-5-yl)ethyl]phenoxy]-3-methylbutane-2,3-diol_major
Ala Ala Asp Val
Ala Ala Val Asp
Ala Asp Ala Val
Ala Asp Gly Ile
Ala Asp Gly Leu
Ala Asp Ile Gly
Ala Asp Leu Gly
Ala Asp Val Ala
Ala Glu Gly Val
Ala Glu Val Gly
Ala Gly Asp Ile
Ala Gly Asp Leu
Ala Gly Glu Val
Ala Gly Ile Asp
Ala Gly Leu Asp
Ala Gly Val Glu
Ala Ile Asp Gly
Ala Ile Gly Asp
Ala Leu Asp Gly
Ala Leu Gly Asp
Ala Pro Ser Thr
Ala Pro Thr Ser
Ala Ser Pro Thr
Ala Ser Thr Pro
Ala Thr Pro Ser
Ala Thr Ser Pro
Ala Val Ala Asp
Ala Val Asp Ala
Ala Val Glu Gly
Ala Val Gly Glu
Asp Ala Ala Val
Asp Ala Gly Ile
Asp Ala Gly Leu
Asp Ala Ile Gly
Asp Ala Leu Gly
Asp Ala Val Ala
Asp Gly Ala Ile
Asp Gly Ala Leu
Asp Gly Ile Ala
Asp Gly Leu Ala
Asp Ile Ala Gly
Asp Ile Gly Ala
Asp Leu Ala Gly
Asp Leu Gly Ala
Asp Val Ala Ala
Glu Ala Gly Val
Glu Ala Val Gly
Glu Gly Ala Val
Glu Gly Gly Ile
Glu Gly Gly Leu
Glu Gly Ile Gly
Glu Gly Leu Gly
Glu Gly Val Ala
Cyclonormammein
Mammea B/BC cyclo E
Mammea b/ac cyclo F
Fragransol A
1-(4-Hydroxy-3,5-dimethoxyphenyl)-2-[2-methoxy-4-(1-propenyl)phenoxy]-1-propanol
(Rac)-Myrislignan
Sonchifolin
1-{4-[2-(7-Methoxy-1,3-benzodioxol-5-yl)ethyl]phenoxy}-3-methyl-2,3-butanediol
2-[6-Acetyl-3-(isobutyryloxy)-2,3-dihydro-1-benzofuran-2-yl]-2-propen-1-yl 2-methylpropanoate
3-(N-Styrylmethyl-2-aminoethylamino)propyltrimethoxysilane hydrochloride
(9,16b)-9,11-Epoxy-16,17,21-trihydroxypregna-1,4-diene-3,20-dione
a-D-Glucopyranoside, methyl2,3-bis-O-(phenylmethyl)-
1H-Benzimidazole-1-acetamide,N-(1-methylethyl)-2-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-(9CI)
1,2-Ethanediamine, N-3-(trimethoxysilyl)propyl-, N-(ethenylphenyl)methyl derivs., hydrochlorides
Isopropyl (2S)-7-Cyano-4-(pyridin-2-ylmethyl)-1,2,3,4-tetrahydrocyclopenta[b]indol-2-ylcarbamate
C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C1636 - Therapeutic Steroid Hormone C147908 - Hormone Therapy Agent > C547 - Hormone Antagonist > C242 - Anti-Androgen
Pyrimidine-4,6-dicarboxylic acid bis-(3-methyl-benzylamide)
N-(1-ethyl-6-methyl-3-pyrazolo[3,4-b]quinolinyl)-2-(4-methoxyphenyl)acetamide
n-[[2-Methyl-4-hydroxycarbamoyl]but-4-yl-n]-benzyl-p-[phenyl]-p-[methyl]phosphinamid
Methyl 2-(furan-3-yl)-7-hydroxy-6a,10b-dimethyl-4-oxo-2,4a,5,6,10,10a-hexahydro-1H-benzo[f]isochromene-7-carboxylate
rel-(-)-(7S,7R,8S,8R)-4,4-dihydroxy-3,3,5-trimethoxy-7,7-epoxylignan
A lignan that is 3,4-dimethyloxolane substituted by a 2-methoxyphenol group at position 5 and a 2,6-dimethoxyphenol group at 2. It has been isolated from the bark of Machilus robusta.
(2S,3R,3aS,7aR)-2-(4-hydroxy-3-methoxyphenyl)-3a,7a-dimethoxy-3-methyl-5-prop-2-enyl-3,7-dihydro-2H-1-benzofuran-6-one
(9b-hydroxy-6,6,9a-trimethyl-1-oxo-3,5,5a,7,8,9-hexahydrobenzo[e][2]benzofuran-5-yl) (2E,4E)-6-oxohexa-2,4-dienoate
N-{3-[2-(1-azepanyl)-4,5-dicyanophenoxy]phenyl}acetamide
N-(2-furanylmethyl)-5,7-dimethyl-6-[(3-methylphenyl)methyl]-3-pyrazolo[1,5-a]pyrimidinecarboxamide
N-cyclohexyl-2-[[5-[(4-methoxyphenyl)methyl]-4-methyl-1,2,4-triazol-3-yl]thio]acetamide
6-(3,5-dimethyl-4-isoxazolyl)-N-[(2-ethoxyphenyl)methyl]-4-quinazolinamine
(2S,3R,4S)-1-[2-(dimethylamino)-1-oxoethyl]-4-(hydroxymethyl)-3-[4-[2-(3-pyridinyl)ethynyl]phenyl]-2-azetidinecarbonitrile
6beta-Hydroxyprednisone
A glucocorticoid that is prednisone carrying a hydroxy group at the 6beta position. It is a metabolite of prednisone found in human urine.
6alpha-Hydroxyprednisone
A glucocorticoid that is prednisone carrying a hydroxy group at the 6alpha position. It is a metabolite of prednisone found in human urine.
(4E,8E)-10-(4,6-dihydroxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4,8-dimethyldeca-4,8-dienoic acid
1-(1,1,2,2,2-Pentamethyldisilanyl)-4-(1-phenyl-1,2,2,2-tetramethyldisilanyl)-1-buten-3-yne
Hexahydrocurcumin
Hexahydrocurcumin is a diarylheptanoid. Hexahydrocurcumin is a natural product found in Zingiber officinale with data available. Hexahydrocurcumin is one of the major metabolites of curcumin and a selective, orally active COX-2 inhibitor. Hexahydrocurcumin is inactive against COX-1. Hexahydrocurcumin has antioxidant, anticancer and anti-inflammatory activities[1][2]. Hexahydrocurcumin is one of the major metabolites of curcumin and a selective, orally active COX-2 inhibitor. Hexahydrocurcumin is inactive against COX-1. Hexahydrocurcumin has antioxidant, anticancer and anti-inflammatory activities[1][2].
8,9-Dihydro-5-hydroxy-8-(1-hydroxy-1-methylethyl)-6-(1-oxobutyl)-4-propyl-2H-furo[2,3-h]-1-benzopyran-2-one
CCK antagonist 1
CCK antagonist 1 (compound 3d) is a CCK antagonist with IC50s of 1.1 μM and 4 μM for CCK1 and CCK2, respectively. CCK antagonist 1 can be used for research of cancer and mental disease[1].
methyl 2-(furan-3-yl)-6a,10b-dimethyl-4,10-dioxo-octahydro-1h-naphtho[2,1-c]pyran-7-carboxylate
(1s,2s,5r,6s,7r)-7-(2h-1,3-benzodioxol-5-yl)-1,3-dimethoxy-6-methyl-5-(prop-2-en-1-yl)bicyclo[3.2.1]oct-3-ene-2,8-diol
methyl (1s,4r,5r,7s,9s,11s,13r,16r,17r)-7-(furan-3-yl)-4-methyl-8,10,12-trioxapentacyclo[11.3.1.0¹,¹¹.0⁵,⁹.0⁵,¹⁶]heptadecane-17-carboxylate
2-[(3,4-dimethoxyphenyl)methoxy]-7a-hydroxy-3-methyl-3a-(prop-2-en-1-yl)-3,4-dihydro-2h-1-benzofuran-7-one
5-(2,5-dihydroxyphenyl)-5-hydroxy-3-{2-[(1r,3s)-3-hydroxy-2,2-dimethyl-6-methylidenecyclohexyl]ethyl}furan-2-one
7-(2h-1,3-benzodioxol-5-yl)-1,3-dimethoxy-6-methyl-5-(prop-2-en-1-yl)bicyclo[3.2.1]oct-3-ene-2,8-diol
4-(3-methoxy-3-oxoprop-1-en-1-yl)-2-(3-methylbut-2-en-1-yl)phenyl 3-(acetyloxy)butanoate
(1r,2s,6r,7r,9r,13r,17s)-15-hydroxy-4-methoxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-4,14-diene-3,11,16-trione
(3s)-9,10-dihydroxy-3-[(2r)-2-hydroxyheptyl]-7-methoxy-3h,4h-naphtho[2,3-c]pyran-1-one
[(2r)-2-(5-methoxy-4-methyl-2-{[(2e)-2-methylbut-2-enoyl]oxy}phenyl)oxiran-2-yl]methyl (2e)-2-methylbut-2-enoate
methyl (2s,4ar,6ar,7r,10ar,10br)-2-(furan-3-yl)-7-hydroxy-6a,10b-dimethyl-4-oxo-1h,2h,4ah,5h,6h,10h,10ah-naphtho[2,1-c]pyran-7-carboxylate
3-{2,3-dimethoxy-4-[(2-methylbut-2-enoyl)oxy]phenyl}prop-2-en-1-yl 2-methylbut-2-enoate
methyl (3ar,4r,11ar)-10-methyl-4-{[(2e)-2-methylbut-2-enoyl]oxy}-3-methylidene-2-oxo-3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-6-carboxylate
4-[(2r,3r)-5-[(1s,2r)-2-hydroxy-1-methoxypropyl]-7-methoxy-3-methyl-2,3-dihydro-1-benzofuran-2-yl]-2-methoxyphenol
6-[(2r,3s)-4-(5-hydroxy-2,4-dimethoxyphenyl)-2,3-dimethylbutyl]-2h-1,3-benzodioxol-5-ol
14,15,16-trimethoxy-9,10-dimethyltricyclo[10.4.0.0²,⁷]hexadeca-1(12),2(7),3,5,13,15-hexaene-3,4,5-triol
(2e)-3-(3,4-dimethoxyphenyl)prop-2-en-1-yl (2z)-2-({[(2z)-2-methylbut-2-enoyl]oxy}methyl)but-2-enoate
(2r)-3-methylidene-2h-furan-2-yl (2e,6e)-8-[(2r)-2-methoxy-4-methyl-5-oxofuran-2-yl]-3,7-dimethylocta-2,6-dienoate
4-[(1r,2s,3s)-2,3-bis(hydroxymethyl)-6,7-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-2-methoxyphenol
7-ethoxy-11-methyl-4-(prop-1-en-2-yl)-14-oxabicyclo[11.2.1]hexadeca-1(16),10-diene-3,6,9,15-tetrone
(1e,3z,4s,6e)-1-(acetyloxy)-3-[(acetyloxy)methylidene]-7,11-dimethyldodeca-1,6,10-trien-8-yn-4-yl acetate
3-methylidene-2h-furan-2-yl 8-(2-methoxy-4-methyl-5-oxofuran-2-yl)-3,7-dimethylocta-2,6-dienoate
5,14,15-trimethoxy-9,10-dimethyltricyclo[10.4.0.0²,⁷]hexadeca-1(12),2(7),3,5,13,15-hexaene-3,4,16-triol
6-[(2r,3s)-4-(2-hydroxy-4,5-dimethoxyphenyl)-2,3-dimethylbutyl]-2h-1,3-benzodioxol-5-ol
furan-3-ylmethyl (2e,6e)-8-[(2r)-2-methoxy-4-methyl-5-oxofuran-2-yl]-3,7-dimethylocta-2,6-dienoate
(1r,2s,5r,8r,10r,11r,13r,16s)-8-(furan-3-yl)-1,16-dihydroxy-2,10-dimethyl-15-methylidene-7,14-dioxatetracyclo[11.2.1.0²,¹¹.0⁵,¹⁰]hexadecan-6-one
5,7-dihydroxy-4-[(1s)-1-hydroxypropyl]-6-(3-methylbut-2-en-1-yl)-8-(2-methylpropanoyl)chromen-2-one
(2-{5-methoxy-4-methyl-2-[(2-methylbut-2-enoyl)oxy]phenyl}oxiran-2-yl)methyl 2-methylbut-2-enoate
(9r,9as)-9-hydroxy-3-[(7r)-7-hydroxyoctanoyl]-6,9a-dimethyl-9h-furo[3,2-g]isochromen-2-one
(1z,3r,4s,6r,7r,8r,11r,13s,15r)-13-hydroxy-6-methyl-17,18-dioxo-16-oxatetracyclo[13.2.2.0³,¹¹.0⁴,⁸]nonadeca-1,9-dien-7-yl acetate
3-hydroxy-1-[4-hydroxy-2-(3-hydroxy-5-methylphenoxy)-6-methylphenyl]-3-methylbutan-2-yl acetate
(3r,5r)-1-(3,4-dihydroxyphenyl)-5-hydroxy-7-(4-hydroxyphenyl)heptan-3-yl acetate
(9s,10r)-5,14,15-trimethoxy-9,10-dimethyltricyclo[10.4.0.0²,⁷]hexadeca-1(12),2(7),3,5,13,15-hexaene-3,4,16-triol
[(5s,7s)-7-hydroxy-3,5-dimethyl-9-(propanoyloxy)-5h,6h,7h,8h-naphtho[2,3-b]furan-4-yl]methyl propanoate
(3s,4e,6e)-8-{[(1r,2s,7r,8ar)-7-hydroxy-1,8a-dimethyl-6-oxo-1,2,7,8-tetrahydronaphthalen-2-yl]oxy}-3-methyl-8-oxoocta-4,6-dienoic acid
(2s,3s,1's,2'r)-and(2s,3s,1'r,2'r)-2,3-dihydro-5-(1',2'-dihydroxypropyl)-2-(3,4-dimethoxyphenyl)-7-methoxy-3-methylbenzofuran
{"Ingredient_id": "HBIN006688","Ingredient_name": "(2s,3s,1's,2'r)-and(2s,3s,1'r,2'r)-2,3-dihydro-5-(1',2'-dihydroxypropyl)-2-(3,4-dimethoxyphenyl)-7-methoxy-3-methylbenzofuran","Alias": "NA","Ingredient_formula": "C21H26O6","Ingredient_Smile": "CC1C(OC2=C(C=C(C=C12)C(C(C)O)O)OC)C3=CC(=C(C=C3)OC)OC","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5595","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
5-o-ethyl-hirsutanonol
{"Ingredient_id": "HBIN011855","Ingredient_name": "5-o-ethyl-hirsutanonol","Alias": "NA","Ingredient_formula": "C21H26O6","Ingredient_Smile": "CCOC(CCC1=CC(=C(C=C1)O)O)CC(=O)CCC2=CC(=C(C=C2)O)O","Ingredient_weight": "374.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "7444","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "11710535","DrugBank_id": "NA"}
(8R,8'R,9S)-4,4'-dihydroxy-3,3',9-trimethoxy-9,9'-epoxylignan
{"Ingredient_id": "HBIN013893","Ingredient_name": "(8R,8'R,9S)-4,4'-dihydroxy-3,3',9-trimethoxy-9,9'-epoxylignan","Alias": "NA","Ingredient_formula": "C21H26O6","Ingredient_Smile": "COC1C(C(CO1)CC2=CC(=C(C=C2)O)OC)CC3=CC(=C(C=C3)O)OC","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "42908","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
altissimacouniarin B
{"Ingredient_id": "HBIN015781","Ingredient_name": "altissimacouniarin B","Alias": "NA","Ingredient_formula": "C21H26O6","Ingredient_Smile": "CC(=CCCC1(C(O1)COC2=C(C=C3C=CC(=O)OC3=C2OC)OC)C)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "34521","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
4-[(2s,3s)-5-[(1s,2s)-2-hydroxy-1-methoxypropyl]-7-methoxy-3-methyl-2,3-dihydro-1-benzofuran-2-yl]-2-methoxyphenol
9b-hydroxy-6,6,9a-trimethyl-1-oxo-3h,5h,5ah,7h,8h,9h-naphtho[1,2-c]furan-5-yl 6-oxohexa-2,4-dienoate
methyl (2s,4as,6ar,9r,10as,10bs)-2-(furan-3-yl)-9-hydroxy-6a,10b-dimethyl-4-oxo-1h,2h,4ah,5h,6h,9h,10h,10ah-naphtho[2,1-c]pyran-7-carboxylate
1-[(2s,3s)-2-(3,4-dimethoxyphenyl)-7-methoxy-3-methyl-2,3-dihydro-1-benzofuran-5-yl]propane-1,2-diol
5,7-dihydroxy-4-[(1r)-1-hydroxypropyl]-6-(3-methylbut-2-en-1-yl)-8-(2-methylpropanoyl)chromen-2-one
(8s,9r)-16,17-dimethoxytricyclo[12.3.1.1²,⁶]nonadeca-1(17),2(19),3,5,14(18),15-hexaene-3,8,9,15-tetrol
(1s,4s,9s,12r)-2-formyl-12-hydroxy-5,5-dimethyl-10-oxo-11-oxatetracyclo[7.3.1.0¹,⁹.0³,⁷]trideca-2,6-dien-4-yl hexanoate
(1r,6ar,10as)-1,11-dihydroxy-12-methoxy-7,7,10a-trimethyl-1h,2h,5h,6h,6ah,9h,10h-phenanthro[1,2-c]pyran-4,8-dione
2-[2-(2,5-dihydroxyphenyl)-2-oxoethylidene]-11-hydroxy-6,10-dimethylundeca-5,9-dienoic acid
3-{[3-(3,4-dimethoxyphenyl)prop-2-en-1-yl]oxy}-2-ethylidene-3-oxopropyl 2-methylbut-2-enoate
methyl 3-[7-hydroxy-6-isopropyl-1-methyl-4,5,8-trioxo-2-(prop-1-en-2-yl)-2,3-dihydronaphthalen-1-yl]propanoate
4-[3-(hydroxymethyl)-5-(3-hydroxypropyl)-7-methoxy-3-methyl-2h-1-benzofuran-2-yl]-2-methoxyphenol
8-(3,4-dimethoxyphenyl)-6,7-bis(hydroxymethyl)-3-methoxy-5,6,7,8-tetrahydronaphthalen-2-ol
7-{[(2e,6e)-8-hydroxy-3,7-dimethylocta-2,6-dien-1-yl]oxy}-6,8-dimethoxychromen-2-one
[(3as,8s,9ar,9bs)-8-(acetyloxy)-3,9-dimethylidene-2-oxo-3ah,4h,5h,7h,8h,9ah,9bh-azuleno[4,5-b]furan-6-yl]methyl 2-methylpropanoate
n-(2-{6-methoxy-3,11,21-triazapentacyclo[12.7.0.0²,¹⁰.0⁴,⁹.0¹⁵,²⁰]henicosa-1(14),4,6,8,10,15,17,19-octaen-2-yl}ethyl)carboximidic acid
4-[(1s,2r,3r)-2,3-bis(hydroxymethyl)-6,7-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-2-methoxyphenol
(1r,2s)-2-(3,4-dimethoxyphenyl)-1-(hydroxymethyl)-8-methoxy-2,4,5,6-tetrahydro-1h-3-benzoxocin-9-ol
(1s,2s,6s,7s,9r,13r,17s)-15-hydroxy-4-methoxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-4,14-diene-3,11,16-trione
16,17-dimethoxytricyclo[12.3.1.1²,⁶]nonadeca-1(17),2(19),3,5,14(18),15-hexaene-3,8,9,15-tetrol
2-(4-hydroxy-3-methoxyphenyl)-3a,7a-dimethoxy-3-methyl-5-(prop-2-en-1-yl)-3,7-dihydro-2h-1-benzofuran-6-one
(2s,3r,3as,7ar)-2-(4-hydroxy-3-methoxyphenyl)-3a,7a-dimethoxy-3-methyl-5-(prop-2-en-1-yl)-3,7-dihydro-2h-1-benzofuran-6-one
4-[2,3-bis(hydroxymethyl)-6,7-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-2-methoxyphenol
(1r,2s,5s,6r,7s,8r)-7-(2h-1,3-benzodioxol-5-yl)-1,3-dimethoxy-6-methyl-5-(prop-2-en-1-yl)bicyclo[3.2.1]oct-3-ene-2,8-diol
(3ar,4r,4as,5s,9ar)-5-(acetyloxy)-4a,8-dimethyl-3-methylidene-2-oxo-3ah,4h,5h,6h,7h,9h,9ah-azuleno[6,5-b]furan-4-yl 2-methylprop-2-enoate
methyl 2-(furan-3-yl)-10-hydroxy-6a,10b-dimethyl-4-oxo-1h,2h,4ah,5h,6h,9h,10h,10ah-naphtho[2,1-c]pyran-7-carboxylate
(1s,5ar,9as)-10-hydroxy-1-(hydroxymethyl)-11-methoxy-6,6,9a-trimethyl-1h,4h,5h,5ah,8h,9h-phenanthro[1,2-c]furan-3,7-dione
6,8-dimethoxy-7-{[3-methyl-3-(4-methylpent-3-en-1-yl)oxiran-2-yl]methoxy}chromen-2-one
(1e,6e)-1-(4-hydroxy-3-methoxycyclohexyl)-7-(4-hydroxy-3-methoxyphenyl)hepta-1,6-diene-3,5-dione
(1s,8s,9s,10r,11r,13r)-8-(acetyloxy)-6,9,10-trimethyl-4,14-dioxatetracyclo[7.5.0.0¹,¹³.0³,⁷]tetradeca-3(7),5-dien-11-yl 2-methylprop-2-enoate
4-[(1r,2s)-2-[2,6-dimethoxy-4-(prop-2-en-1-yl)phenoxy]-1-hydroxypropyl]-2-methoxyphenol
10-hydroxy-1-(hydroxymethyl)-11-methoxy-6,6,9a-trimethyl-1h,4h,5h,5ah,8h,9h-phenanthro[1,2-c]furan-3,7-dione
methyl 3-[(1s,2s)-7-hydroxy-6-isopropyl-1-methyl-4,5,8-trioxo-2-(prop-1-en-2-yl)-2,3-dihydronaphthalen-1-yl]propanoate
15-hydroxy-4-methoxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-4,14-diene-3,11,16-trione
(2e)-4-(2,5-dihydroxyphenyl)-2-{2-[(5s)-5-hydroxy-2,6,6-trimethylcyclohex-1-en-1-yl]ethyl}-4-oxobut-2-enoic acid
8-butanoyl-5,7-dihydroxy-4-[(1s)-1-hydroxypropyl]-6-(3-methylbut-2-en-1-yl)chromen-2-one
methyl 5-[2-(furan-3-yl)-2-oxoethyl]-8a-hydroxy-1,5,6-trimethyl-3-oxo-2,6,7,8-tetrahydronaphthalene-1-carboxylate
(8s,9s)-16,17-dimethoxytricyclo[12.3.1.1²,⁶]nonadeca-1(17),2(19),3,5,14(18),15-hexaene-3,8,9,15-tetrol
(1s,2s,6r,7s,9z,11r)-11-methoxy-9,13-dimethyl-5-methylidene-4-oxo-3,14-dioxatricyclo[9.2.1.0²,⁶]tetradeca-9,12-dien-7-yl (2e)-2-methylbut-2-enoate
2-{2-[(5s)-5-[(1r)-1-[(2r)-2-methoxy-4-methyl-5-oxofuran-2-yl]-2-methylprop-2-en-1-yl]-2-oxo-5h-furan-3-yl]ethyl}-3-methylbut-2-enal
(3ar,4r,11ar)-6-methyl-3-methylidene-4-{[(2e)-3-methylpent-2-enoyl]oxy}-2-oxo-3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-10-carboxylic acid
11-ethoxy-9,13-dimethyl-5-methylidene-4-oxo-3,14-dioxatricyclo[9.2.1.0²,⁶]tetradeca-9,12-dien-7-yl 2-methylprop-2-enoate
(2e)-3-(3,5-dimethoxy-4-{[(2z)-2-methylbut-2-enoyl]oxy}phenyl)prop-2-en-1-yl (2z)-2-methylbut-2-enoate
3',9'-dihydroxy-2,4'b,7'-trimethyl-8'-methylidene-1',4'-dioxo-5',6',7',8'a,9',10'-hexahydro-3'h-spiro[cyclopropane-1,2'-phenanthren]-10'-yl formate
5-(7-hydroxy-6,8-dimethoxy-2,3-dimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)-3-methoxybenzene-1,2-diol
4-[(1r,2r)-2-[2,6-dimethoxy-4-(prop-2-en-1-yl)phenoxy]-1-hydroxypropyl]-2-methoxyphenol
(1e,4s,5r,7r,10r,12e)-1-chloro-12-(chloromethylidene)-5,7-dimethylheptadec-1-en-16-yne-4,10-diol
C20H32Cl2O2 (374.17792319999995)