Exact Mass: 402.171215
Exact Mass Matches: 402.171215
Found 500 metabolites which its exact mass value is equals to given mass value 402.171215
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Clusin
Clusin is found in herbs and spices. Clusin is a constituent of Piper cubeba (cubeb pepper)
6-Hydroxy-9,9-dimethyl-5-(3-methyl-1-oxobutyl)-1-propyl-3H,9H-[1,2]-dioxolo[3',4':4,5]furo[2,3-f][1]benzopyran-3-one
6-Hydroxy-9,9-dimethyl-5-(3-methyl-1-oxobutyl)-1-propyl-3H,9H-[1,2]-dioxolo[3,4:4,5]furo[2,3-f][1]benzopyran-3-one is found in fruits. 6-Hydroxy-9,9-dimethyl-5-(3-methyl-1-oxobutyl)-1-propyl-3H,9H-[1,2]-dioxolo[3,4:4,5]furo[2,3-f][1]benzopyran-3-one is isolated from Mammea americana (mamey). 6-Hydroxy-9,9-dimethyl-5-(3-methyl-1-oxobutyl)-1-propyl-3H,9H-[1,2]-dioxolo[3,4:4,5]furo[2,3-f][1]benzopyran-3-one is an oxidation produced of Mammein.
2-(4-(3-(4-Acetyl-3-hydroxy-2-propylphenoxy)propoxy)phenoxy)acetic acid
L-165041 is a cell permeable PPARδ agonist, with Kis of 6 nM and appr 730 nM for PPARδ and PPARγ, respectively, and induces adipocyte differentiation in NIH-PPARδ cells.
[3aS-[3aalpha,4beta,5beta,6alpha,7alpha(Z),7abeta]]-4-(Acetyloxy)-6-ethenyl-5-(1-formylethenyl)octahydro-6-methyl-3-methylene-2-oxo-7-benzofuranyl ester 2-methyl-2-butenoic acid
9beta-Hydroxy-8beta-(5-acetoxy-tiglinoyloxy)-lasiolaenin
[3aS-[3aalpha,4beta(Z),5beta,6alpha,7alpha,7abeta]]-7-(Acetyloxy)-6-ethenyl-5-(1-formylethenyl)octahydro-6-methyl-3-methylene-2-oxo-4-benzofuranyl ester 2-methyl-2-butenoic acid
[3aS-[3aalpha,4alpha,5beta(Z),9alpha,9aalpha,9bbeta]]-4-(Acetyloxy)-2,3,3a,4,5,9,9a,9b-octahydro-9-hydroxy-6,9-dimethyl-3-methylene-2-oxoazuleno[4,5-b]furan-5-yl ester 2-methyl-2-butenoic acid
8beta-Hydroxy-9beta-(5-acetoxy-tiglinoyloxy)-lasiolaenin
[3aS-[3aalpha,4alpha,5beta(Z),9beta,9aalpha,9bbeta]]-4-(Acetyloxy)-2,3,3a,4,5,9,9a,9b-octahydro-9-hydroxy-6,9-dimethyl-3-methylene-2-oxoazuleno[4,5-b]furan-5-yl ester 2-methyl-2-butenoic acid
Antiarone K
AVE5638
C25H23FN2O2 (402.17434699999995)
CONFIDENCE standard compound; INTERNAL_ID 479; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8392; ORIGINAL_PRECURSOR_SCAN_NO 8390 CONFIDENCE standard compound; INTERNAL_ID 479; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8421; ORIGINAL_PRECURSOR_SCAN_NO 8418 CONFIDENCE standard compound; INTERNAL_ID 479; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8427; ORIGINAL_PRECURSOR_SCAN_NO 8425 CONFIDENCE standard compound; INTERNAL_ID 479; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8465; ORIGINAL_PRECURSOR_SCAN_NO 8463 CONFIDENCE standard compound; INTERNAL_ID 479; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8474; ORIGINAL_PRECURSOR_SCAN_NO 8472 CONFIDENCE standard compound; INTERNAL_ID 479; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8478; ORIGINAL_PRECURSOR_SCAN_NO 8477
(R,S)-5-methoxy-8-<(6,7-dihydroxy-3,7-dimethyl-2-octenyl)oxy>psoralen
15-acetyloxy-8beta-angeloyloxy-14-oxo-(4Z)-acanthospermolide
6beta-acetoxy-2-oxo-8beta-tigloyloxygermacra-3E,10(14),11(13)-trien-12,6alpha-olide
8beta-(4-acetoxytigloyloxy)-14-oxo-acanthospermolide|8beta-<4-acetoxytigloyloxy>-14-oxo-acanthospermolide|melampolide
(7S,8R,2R,3S,5R)-Delta8-2-hydroxy-5,5-dimethoxy-3,4-methylenedioxy-2,3,4,5-tetrahydro-2-oxo-7.3,8.5-neolignan|cinerin D
1,3,3aalpha,4alpha,9,9abeta-hexahydro-4-(4-hydroxy-3,5-dimethoxyphenyl)-5,7-dimethoxynaphtho[2,3-c]furan-6-ol|gaultherin C
(+)-2alpha-(3,4-dimethoxyphenyl)-6alpha-(3-hydroxy-4,5-dimethoxyphenyl)-3,7-dioxabicyclo[3.3.0]octane|De-O-methylmagnolin
2beta-Acetoxy-4a,7-dihydroxy-1beta-methyl-8-methylen-4aalpha,7beta-gibb-3-en-1alpha,10beta-dicarbonsaeure-1=>4a-lacton-10-methylester|2beta-acetoxy-4a,7-dihydroxy-1beta-methyl-8-methylene-4aalpha,7beta-gibb-3-ene-1alpha,10beta-dicarboxylic acid-1=>4a lactone-10-methyl ester|ent-3alpha-acetoxy-13-hydroxy-gibberella-1,16-dien-7-oic acid 7-mehyl ester 19,10-lactone
14alpha-hydroxy-7alpha-carboxyl-11,16-diketoapian-8-en-(20,6)-olied|yantuine I
Delta7-4-hydroxy-3,5,3,5-tetramethoxy-7-oxo-8-O-4-neolignan
3beta-hydroxy-8alpha-(5-acetoxyangeloyloxy)-eremanthin|3beta-hydroxy-8alpha-<5-acetoxyangeloyloxy>-eremanthin
(-)-traxillagenin|(2R,3R)-2-4-hydroxy-3-methoxybenzyl-3-3,4,5-trimethoxybenzylbutyrolactone|traxillagenin
3,4-Dimethoxybenzoic acid 1-(3,4-dimethoxyphenyl)-2-methyl-3-oxobutyl ester
rel-(7S,8R,1S,2R,3S,4S)-Delta8-4-acetoxy-2-hydroxi-3-methoxy-3,4-methylenedioxy-1,2,3,4,5,6-hexahydro-5-oxo-7.3,8.1-neolignan
(2R-trans) 2,3-dihydro-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-5-benzofuranpropanol acetate
2beta-acetoxy-7-keto-ent-clerodan-3,13-dien-18,19:16,15-diolide|2beta-Acetoxy-7-keto-neo-clerodan-3,13-dien-18,19:16,15-diolide
6-(3-Methyl-2-butenoyl),8-Ac-(1alpha,5beta,6alpha,8beta,9beta,10alpha)-6,8-Dihydroxy-4-oxo-2,11(13)-pseudoguaiadien-12,9-olide
19-acetoxy-6,20:6,11beta-diepoxy-6,7-seco-ent-kaur-16-en-15-one-1beta,7-olide|enanderianin F
3,4-bis-(3,4-dimethoxy-benzyl)-3-hydroxy-dihydro-furan-2-one|Dimethylaether von Pinopalustrin|methyltrachelogenin
8beta-acetyloxy-15-angeloyloxy-14-oxo-(4Z)-acanthospermolide
6-Tigloyl,8-Ac-(1alpha,5beta,6alpha,8beta,9beta,10alpha)-6,8-Dihydroxy-4-oxo-2,11(13)-pseudoguaiadien-12,9-olide|8-O-acetyl-desacyllinearifolin B-6-O-tiglate
(+)-4-hydroxy-2,6-di(3,4-dimethoxy)phenyl-3,7-dioxabicyclo[3.3.0]octane
comazaphilone A
An azaphilone that is 5,6,7,8-tetrahydro-1H-isochromene substituted by a hydroxy group at position 6, a methyl group at position 7, an oxo group at position 8, a propyl group at position 3 and a (4-hydroxy-2-methoxy-6-methylbenzoyl)oxy group at position 7. It has been isolated from Penicillium commune.
beilschminol A|rel-(7R,8R,7R,8R)-3-hydroxy-3,4-methylenedioxy-4,5,5-trimethoxy-7,7-epoxylignan
(7S,8R)-9?-dimethoxydihydroconifryl alcohol|viterolignan B
2-methoxy-4-{4-methoxy-6-[(2R*,3S*,4S*,5R*)-2,3,4,5-tetrahydro-5-methoxy-3,4-dimethyltetrahydrofuran-2-yl]-1,3-benzodioxol-5-yl}phenol|gymnothelignan R
1-(7-Methoxy-1,3-benzodioxol-5-yl)-2-[(2,6-dimethoxy-4-allylphenyl)oxy]-1-propanol
15alpha-acetoxy-6alpha-hydroxy-20-oxo-6,11-epoxy-6,7-seco-1alpha,7-olide-ent-kaur-9-(11),16-diene|isorosthin B
8beta-angeloyloxy-9alpha-acetoxy-14-oxo-acanthospermolide|8beta-Angeloyloxy-9alpha-acetoxy-14-oxoacanthospemolid
6beta-acetoxy-2-oxo-8beta-tigloyloxygermacra-4(15),10(14),11(13)-trien-12,6alpha-olide
5beta-acetoxy-2-oxo-8beta-tigloyloxygermacra-1(10)E,4(15),11(13)trien-12,6alpha-olide
[3aS-[3aalpha,4beta(Z),5beta,6alpha,7alpha,7abeta]]-7-(Acetyloxy)-6-ethenyl-5-(1-formylethenyl)octahydro-6-methyl-3-methylene-2-oxo-4-benzofuranyl ester 2-methyl-2-butenoic acid
(6R,7R,8R)-3-Oxo-8-acetoxysarracenyloxyhelianga-1(10),4,11(13)-trien-6,12-olide
9beta-acetoxy-8-O-(2,3-epoxy-2-methylbutyryl)-desacetyl-zuzubergenin|9beta-acetoxy-8-O-<2,3-epoxy-2-methylbutyryl>-desacetyl-zuzubergenin
1-[2,4-Dihydroxy-3-(3-hydroxy-2-methoxy-3-methylbutyl)-6-methoxyphenyl]-3-(4-hydroxyphenyl)propenone
3beta-hydroxy-8alpha-(4-acetoxyangeloyloxy)-eremanthin|3beta-hydroxy-8alpha-<4-acetoxyangeloyloxy>-eremanthin
(-)-(7R,8S,7E)-3,4,5,5-tetramethoxy-4,7-epoxy-8,3-neolign-7-ene-9,9-diol|woorenogenin
rel-(7R,8S,7S,8S)-4-hydroxy-4,5-methylenedioxy-3,5,3-trimethoxy-7,7-epoxylignan
(1S, 3S, 5R, 6R, 7R, 8S)-8-<2-(1-acetoxyethyl)-propenoyloxyl>-3-hydroxyguai-4(15), 10(14), 11(13)-triene-6,12-olide|(1S, 3S, 5R, 6R, 7R, 8S)-8-[2-(1-acetoxyethyl)-propenoyloxyl]-3-hydroxyguai-4(15), 10(14), 11(13)-triene-6,12-olide
2-Deoxo-8-O-acetyl pumilin|2-deoxo-8-O-acetyl-pumilin
5beta-acetoxy-2-oxo-8beta-tigloyloxygermacra-1(10)E,3Z,11(13)-trien-12,6alpha-olide
2alpha-hydroxy-7alpha-acetoxy-12-oxo-15:16-epoxy-neoclerodan-3,13(16),14-trien-18:19-olide|7-Ac-(ent-2beta,7beta)-15,16-Epoxy-2,7-dihydroxy-3,13(16)14-clerodatrien-18,19-olide
rel-(7S,8R,1S,4R,5R)-4-hidroxy-3,3,5-trimethoxy-4,5-methylenedioxy-6-oxo-Delta-1,3,5,2,8-8.1,7.5-neolignan
2-Deoxo-5-deoxy-8-O-acetyl-17,18-epoxy pumilin|2-deoxo-5-deoxy-8-O-acetyl-17,18-epoxy-pumilin
4-(4-hydroxy-2-methoxy-3,5,6-trimethylbenzoyl)oxy-2-methoxy-3,5,6-trimethylbenzoic acid
3,6-bis(3,4-dimethoxyphenyl)-3,4,6,6a-tetrahydro-1H-furo[3,4-c]furan-3a-ol
[2-[2-(2-methylpropanoyloxy)propan-2-yl]-7-oxo-2,3-dihydrofuro[3,2-g]chromen-3-yl] 2-methylpropanoate
C22H26O7_7-Hydroxy-7-methyl-8-oxo-3-propyl-5,6,7,8-tetrahydro-1H-isochromen-6-yl 2-hydroxy-4-methoxy-6-methylbenzoate
C22H26O7_6-Hydroxy-7-methyl-8-oxo-3-propyl-5,6,7,8-tetrahydro-1H-isochromen-7-yl 2-hydroxy-4-methoxy-6-methylbenzoate
C22H26O7_6(2H)-Benzofuranone, 3,3a,4,5-tetrahydro-5,7-dimethoxy-2-(7-methoxy-1,3-benzodioxol-5-yl)-3-methyl-3a-(2-propen-1-yl)-, (2R,3R,3aR,5R)
[2-[2-(2-methylpropanoyloxy)propan-2-yl]-7-oxo-2,3-dihydrofuro[3,2-g]chromen-3-yl] 2-methylpropanoate
(2R,3R,3aR,5R)-5,7-dimethoxy-2-(7-methoxy-1,3-benzodioxol-5-yl)-3-methyl-3a-prop-2-enyl-2,3,4,5-tetrahydro-1-benzofuran-6-one
3,6-bis(3,4-dimethoxyphenyl)-3,4,6,6a-tetrahydro-1H-furo[3,4-c]furan-3a-ol [IIN-based on: CCMSLIB00000847080]
[2-[2-(2-methylpropanoyloxy)propan-2-yl]-7-oxo-2,3-dihydrofuro[3,2-g]chromen-3-yl] 2-methylpropanoate [IIN-based: Match]
4-(4-hydroxy-2-methoxy-3,5,6-trimethylbenzoyl)oxy-2-methoxy-3,5,6-trimethylbenzoic acid [IIN-based: Match]
4-(4-hydroxy-2-methoxy-3,5,6-trimethylbenzoyl)oxy-2-methoxy-3,5,6-trimethylbenzoic acid [IIN-based on: CCMSLIB00000847923]
3,6-bis(3,4-dimethoxyphenyl)-3,4,6,6a-tetrahydro-1H-furo[3,4-c]furan-3a-ol [IIN-based: Match]
[2-[2-(2-methylpropanoyloxy)propan-2-yl]-7-oxo-2,3-dihydrofuro[3,2-g]chromen-3-yl] 2-methylpropanoate [IIN-based on: CCMSLIB00000848909]
L-165041
CONFIDENCE standard compound; INTERNAL_ID 353; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5390; ORIGINAL_PRECURSOR_SCAN_NO 5386 CONFIDENCE standard compound; INTERNAL_ID 353; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5389; ORIGINAL_PRECURSOR_SCAN_NO 5387 CONFIDENCE standard compound; INTERNAL_ID 353; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5422; ORIGINAL_PRECURSOR_SCAN_NO 5420 CONFIDENCE standard compound; INTERNAL_ID 353; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5409; ORIGINAL_PRECURSOR_SCAN_NO 5406 CONFIDENCE standard compound; INTERNAL_ID 353; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5488; ORIGINAL_PRECURSOR_SCAN_NO 5486 CONFIDENCE standard compound; INTERNAL_ID 353; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5414; ORIGINAL_PRECURSOR_SCAN_NO 5413 CONFIDENCE standard compound; INTERNAL_ID 353; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10028; ORIGINAL_PRECURSOR_SCAN_NO 10026 CONFIDENCE standard compound; INTERNAL_ID 353; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10047; ORIGINAL_PRECURSOR_SCAN_NO 10042 CONFIDENCE standard compound; INTERNAL_ID 353; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10073; ORIGINAL_PRECURSOR_SCAN_NO 10069 CONFIDENCE standard compound; INTERNAL_ID 353; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10089; ORIGINAL_PRECURSOR_SCAN_NO 10084 CONFIDENCE standard compound; INTERNAL_ID 353; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10068; ORIGINAL_PRECURSOR_SCAN_NO 10066 CONFIDENCE standard compound; INTERNAL_ID 353; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10106; ORIGINAL_PRECURSOR_SCAN_NO 10104 L-165041 is a cell permeable PPARδ agonist, with Kis of 6 nM and appr 730 nM for PPARδ and PPARγ, respectively, and induces adipocyte differentiation in NIH-PPARδ cells.
[2-[2-(2-methylpropanoyloxy)propan-2-yl]-7-oxo-2,3-dihydrofuro[3,2-g]chromen-3-yl] 2-methylpropanoate_major
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1-Pyridin-2-yl-9H-beta-carboline
Canellin E
Lorajmine
C22H27ClN2O3 (402.17101020000007)
C - Cardiovascular system > C01 - Cardiac therapy > C01B - Antiarrhythmics, class i and iii > C01BA - Antiarrhythmics, class ia C78274 - Agent Affecting Cardiovascular System > C47793 - Antiarrhythmic Agent D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents
l-n-valyl-l-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid benzyl ester hcl
C22H27ClN2O3 (402.17101020000007)
L-N-VALYL-L-1,2,3,4-TETRAHYDROISOQUINOLINE-3-CARBOXYLIC ACID BENZYL ESTER HYDROCHLORIDE
C22H27ClN2O3 (402.17101020000007)
SKF-96365
C22H27ClN2O3 (402.17101020000007)
D006401 - Hematologic Agents > D010975 - Platelet Aggregation Inhibitors D002317 - Cardiovascular Agents > D002121 - Calcium Channel Blockers D000077264 - Calcium-Regulating Hormones and Agents D049990 - Membrane Transport Modulators
1-{3-[1-({5-[(2-Fluorophenyl)ethynyl]furan-2-yl}carbonyl)piperidin-4-yl]phenyl}methanamine
C25H23FN2O2 (402.17434699999995)
4-(4-Hydroxy-2-methoxy-3,5,6-trimethylbenzoyl)oxy-2-methoxy-3,5,6-trimethylbenzoic acid
2-(3-(Isobutyryloxy)-7-oxo-2,3-dihydro-7H-furo[3,2-g]chromen-2-yl)propan-2-yl isobutyrate
5,7-Dimethoxy-2-(7-methoxy-1,3-benzodioxol-5-yl)-3-methyl-3a-prop-2-enyl-2,3,4,5-tetrahydro-1-benzofuran-6-one
Oxygenated xanthohumol
A member of the class of chalcones that is trans-chalcone substituted by hydroxy groups at positions 4, 2 and 4, a methoxy group at position 6 and a 2-hydroxy-3-methoxy-3-methylbutyl group at position 3. It has been isolated as a racemate from Humulus lupulus and has been shown to exhibit inhibitory activity against NO production.
6-amino-4-(2,5-dimethoxyphenyl)-3-methyl-1-(4-methylphenyl)-4H-pyrano[2,3-c]pyrazole-5-carbonitrile
(-)-(7R,8S,7E)-3,4,5,5-tetramethoxy-4,7-epoxy-8,3-neolign-7-ene-9,9-diol
A neolignan isolated from the stems of Sinocalamus affinis.
2-[4-[3-[3-Hydroxy-4-(2-oxoethyl)-2-propylphenoxy]propoxy]phenoxy]acetic acid
N-[2-[1-methyl-5-[[(4-methylphenyl)-oxomethyl]amino]-2-benzimidazolyl]ethyl]-2-furancarboxamide
4-fluoro-N-[(2R,3R,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(4-pyrimidinylmethylamino)ethyl]-3-oxanyl]benzamide
4-fluoro-N-[(2S,3R,6S)-2-(hydroxymethyl)-6-[2-oxo-2-(pyrimidin-4-ylmethylamino)ethyl]oxan-3-yl]benzamide
4-fluoro-N-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-oxo-2-(4-pyrimidinylmethylamino)ethyl]-3-oxanyl]benzamide
4-fluoro-N-[(2S,3R,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(4-pyrimidinylmethylamino)ethyl]-3-oxanyl]benzamide
4-fluoro-N-[(2S,3S,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(4-pyrimidinylmethylamino)ethyl]-3-oxanyl]benzamide
N-[(2S,3R,6R)-6-[2-[[(2-fluorophenyl)-oxomethyl]amino]ethyl]-2-(hydroxymethyl)-3-oxanyl]-2-pyrazinecarboxamide
N-[(2S,3S,6R)-6-[2-[[(2-fluorophenyl)-oxomethyl]amino]ethyl]-2-(hydroxymethyl)-3-oxanyl]-2-pyrazinecarboxamide
N-[(2S,3R,6S)-6-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-2-pyrazinecarboxamide
N-[(2S,3S,6S)-6-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-2-pyrazinecarboxamide
N-[(2R,3R,6S)-6-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-2-pyrazinecarboxamide
(6R,7R,8R)-7-[4-(2-cyclopropylethynyl)phenyl]-8-(hydroxymethyl)-4-[oxo(2-pyrazinyl)methyl]-1,4-diazabicyclo[4.2.0]octan-2-one
(6S,7R,8S)-7-[4-(2-cyclopropylethynyl)phenyl]-8-(hydroxymethyl)-4-[oxo(2-pyrazinyl)methyl]-1,4-diazabicyclo[4.2.0]octan-2-one
4-fluoro-N-[(2R,3S,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(4-pyrimidinylmethylamino)ethyl]-3-oxanyl]benzamide
4-fluoro-N-[(2R,3S,6S)-2-(hydroxymethyl)-6-[2-oxo-2-(4-pyrimidinylmethylamino)ethyl]-3-oxanyl]benzamide
4-fluoro-N-[(2R,3R,6S)-2-(hydroxymethyl)-6-[2-oxo-2-(4-pyrimidinylmethylamino)ethyl]-3-oxanyl]benzamide
N-[(2S,3R,6S)-6-[2-[[(2-fluorophenyl)-oxomethyl]amino]ethyl]-2-(hydroxymethyl)-3-oxanyl]-2-pyrazinecarboxamide
N-[(2R,3S,6R)-6-[2-[[(2-fluorophenyl)-oxomethyl]amino]ethyl]-2-(hydroxymethyl)-3-oxanyl]-2-pyrazinecarboxamide
N-[(2R,3R,6R)-6-[2-[[(2-fluorophenyl)-oxomethyl]amino]ethyl]-2-(hydroxymethyl)-3-oxanyl]-2-pyrazinecarboxamide
N-[(2R,3S,6S)-6-[2-[[(2-fluorophenyl)-oxomethyl]amino]ethyl]-2-(hydroxymethyl)-3-oxanyl]-2-pyrazinecarboxamide
N-[(2S,3S,6S)-6-[2-[[(2-fluorophenyl)-oxomethyl]amino]ethyl]-2-(hydroxymethyl)-3-oxanyl]-2-pyrazinecarboxamide
N-[(2R,3R,6S)-6-[2-[[(2-fluorophenyl)-oxomethyl]amino]ethyl]-2-(hydroxymethyl)-3-oxanyl]-2-pyrazinecarboxamide
N-[(2R,3S,6R)-6-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-2-pyrazinecarboxamide
N-[(2S,3R,6R)-6-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-2-pyrazinecarboxamide
N-[(2R,3S,6S)-6-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-2-pyrazinecarboxamide
N-[(2R,3R,6R)-6-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-2-pyrazinecarboxamide
N-[(2S,3S,6R)-6-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-2-pyrazinecarboxamide
(4-fluorophenyl)-[(1S,5R)-7-[4-(4-methoxyphenyl)phenyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]methanone
C25H23FN2O2 (402.17434699999995)
[(3aS,4S,9bS)-4-(hydroxymethyl)-8-phenyl-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-1-yl]-(3-fluorophenyl)methanone
C25H23FN2O2 (402.17434699999995)
(6S,7S,8S)-7-[4-(2-cyclopropylethynyl)phenyl]-8-(hydroxymethyl)-4-[oxo(2-pyrazinyl)methyl]-1,4-diazabicyclo[4.2.0]octan-2-one
(6S,7S,8R)-7-[4-(2-cyclopropylethynyl)phenyl]-8-(hydroxymethyl)-4-[oxo(2-pyrazinyl)methyl]-1,4-diazabicyclo[4.2.0]octan-2-one
(6R,7R,8S)-7-[4-(2-cyclopropylethynyl)phenyl]-8-(hydroxymethyl)-4-[oxo(2-pyrazinyl)methyl]-1,4-diazabicyclo[4.2.0]octan-2-one
(6S,7R,8R)-7-[4-(2-cyclopropylethynyl)phenyl]-8-(hydroxymethyl)-4-[oxo(2-pyrazinyl)methyl]-1,4-diazabicyclo[4.2.0]octan-2-one
(6R,7S,8R)-7-[4-(2-cyclopropylethynyl)phenyl]-8-(hydroxymethyl)-4-[oxo(2-pyrazinyl)methyl]-1,4-diazabicyclo[4.2.0]octan-2-one
(6R,7S,8S)-7-[4-(2-cyclopropylethynyl)phenyl]-8-(hydroxymethyl)-4-[oxo(2-pyrazinyl)methyl]-1,4-diazabicyclo[4.2.0]octan-2-one
6-Hydroxy-9,9-dimethyl-5-(3-methyl-1-oxobutyl)-1-propyl-3H,9H-[1,2]-dioxolo[3,4:4,5]furo[2,3-f][1]benzopyran-3-one
1,4-bis[(4-hydroxyphenyl)methyl] (2r)-2-hydroxy-2-(2-methylpropyl)butanedioate
(1r,2r,4r,4ar,5's,8as)-5-formyl-5'-(furan-3-yl)-4-hydroxy-2-methyl-2'-oxo-2,3,4,7,8,8a-hexahydrospiro[naphthalene-1,3'-oxolan]-4a-ylmethyl acetate
(3r,4r)-4-[(r)-(3,4-dimethoxyphenyl)(hydroxy)methyl]-3-[(3,4-dimethoxyphenyl)methyl]oxolan-2-one
(7s)-7-hydroxy-7-methyl-8-oxo-3-propyl-5,6-dihydro-1h-isochromen-6-yl 4-hydroxy-2-methoxy-6-methylbenzoate
(4r)-4-{[(3s)-2,3-dihydroxyindol-3-yl]methyl}-1-(propan-2-ylidene)-2h,3h,4h-pyrazino[2,1-b]quinazolin-6-one
6,10-dimethyl-3-methylidene-2,9-dioxo-3ah,4h,5h,8h,11ah-cyclodeca[b]furan-4-yl 2-[(acetyloxy)methyl]but-2-enoate
(3as,4s,9as)-4-(4-hydroxy-3,5-dimethoxyphenyl)-5,7-dimethoxy-1h,3h,3ah,4h,9h,9ah-naphtho[2,3-c]furan-6-ol
3-[4,6-dimethoxy-5-(3-methylbut-2-en-1-yl)cyclohexa-1,3-dien-1-yl]-3,5,7-trihydroxy-2h-1-benzopyran-4-one
4,5,19-trimethoxy-9,10-dimethyl-15,17-dioxatetracyclo[10.7.0.0²,⁷.0¹⁴,¹⁸]nonadeca-1(12),2(7),3,5,13,18-hexaene-3,11-diol
1-[2,4-dihydroxy-3-(2-hydroxy-3-methoxy-3-methylbutyl)-6-methoxyphenyl]-3-(4-hydroxyphenyl)prop-2-en-1-one
4-(4-hydroxy-3,5-dimethoxyphenyl)-5,7-dimethoxy-1h,3h,3ah,4h,9h,9ah-naphtho[2,3-c]furan-6-ol
5''-(furan-3-yl)-6'-methyl-2'',8'-dioxo-hexahydrodispiro[oxirane-2,1'-naphthalene-5',3''-oxolan]-8'a-ylmethyl acetate
[2-(4-hydroxy-3-methoxyphenyl)-4-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-3-yl]methyl acetate
(2e,6e)-9-[(5r)-5-(2,5-dihydroxyphenyl)-5-methoxy-2-oxofuran-3-yl]-2,6-dimethylnona-2,6-dienoic acid
6-(2-formyl-6-hydroxy-4-methylphenoxy)-2-methoxy-3-(1-methoxy-3-methylbutyl)benzoic acid
methyl (6e)-8-hydroxy-15-methoxy-5-oxo-2,9-bis(prop-1-en-2-yl)-4,14-dioxatricyclo[9.2.1.1³,⁶]pentadeca-1(13),6,11-triene-12-carboxylate
4-[(3,4-dimethoxyphenyl)methyl]-3-[(3-hydroxy-4,5-dimethoxyphenyl)methyl]oxolan-2-one
(1r,5r,9r,17r)-9,17-dihydroxy-13,17-dimethyl-3-oxo-5-pentyl-4,8,14-trioxatetracyclo[7.7.1.0²,⁷.0¹¹,¹⁶]heptadeca-2(7),10,12,15-tetraene-10-carbaldehyde
5-[4-(3,4-dimethoxyphenyl)-hexahydrofuro[3,4-c]furan-1-yl]-2,3-dimethoxyphenol
(3s,3ar,4r,9as,9bs)-4-(acetyloxy)-3,6,9-trimethyl-2,7-dioxo-3ah,4h,5h,9ah,9bh-azuleno[4,5-b]furan-3-yl (2z)-2-methylbut-2-enoate
[(3ar,4r,11ar)-4-(acetyloxy)-6-formyl-3-methylidene-2-oxo-3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-10-yl]methyl (2z)-2-methylbut-2-enoate
5,14-dihydroxy-3,4,15,16-tetramethoxy-9,10-dimethyltricyclo[10.4.0.0²,⁷]hexadeca-1(16),2(7),3,5,12,14-hexaen-8-one
9-[(6,7-dihydroxy-3,7-dimethyloct-2-en-1-yl)oxy]-4-methoxyfuro[3,2-g]chromen-7-one
7-(acetyloxy)-9-methyl-3,6-dimethylidene-2-oxo-3ah,4h,5h,6ah,7h,9ah,9bh-azuleno[4,5-b]furan-4-yl 4-hydroxy-2-methylbut-2-enoate
{13-methyl-3-methylidene-2,18-dioxo-7,9,17-trioxahexacyclo[9.7.1.1¹,⁴.0⁶,¹⁹.0⁸,¹².0¹¹,¹⁶]icosan-13-yl}methyl acetate
9-[5-(2,5-dihydroxyphenyl)-5-methoxy-2-oxofuran-3-yl]-2,6-dimethylnona-2,6-dienoic acid
(1s,4r,5r,6s,7r)-4-hydroxy-1,5-dimethoxy-6-(7-methoxy-2h-1,3-benzodioxol-5-yl)-7-methyl-3-(prop-2-en-1-yl)bicyclo[3.2.1]oct-2-en-8-one
9-methyl-3,6-dimethylidene-2-oxo-3ah,4h,5h,6ah,7h,9ah,9bh-azuleno[4,5-b]furan-4-yl 2-[(acetyloxy)methyl]-4-hydroxybut-2-enoate
(8s,11r,12r,18r,19s)-14,14,18-trimethyl-9,13,17-trioxo-4,10-dioxatetracyclo[9.7.1.0³,⁷.0⁸,¹⁹]nonadeca-3(7),5-dien-12-yl acetate
6,9-dihydroxy-4-(1h-indol-3-ylmethyl)-7-methyl-2,5,16-triazatetracyclo[7.7.0.0²,⁷.0¹⁰,¹⁵]hexadeca-5,10,12,14-tetraen-3-one
(7r,8s,8as)-8-hydroxy-7-methyl-6-oxo-3-propyl-8,8a-dihydro-1h-isochromen-7-yl 4-hydroxy-2-methoxy-6-methylbenzoate
(3ar,4r,6ar,9ar,9br)-9-methyl-3,6-dimethylidene-2-oxo-3ah,4h,5h,6ah,7h,9ah,9bh-azuleno[4,5-b]furan-4-yl (2e)-4-(acetyloxy)-2-(hydroxymethyl)but-2-enoate
3-{[4-acetyl-2,3,6-trihydroxy-5-(3-methylbut-2-en-1-yl)phenyl]methyl}-6-ethyl-4-hydroxy-5-methylpyran-2-one
6-hydroxy-7-methyl-8-oxo-3-propyl-5,6-dihydro-1h-isochromen-7-yl 4-hydroxy-2-methoxy-6-methylbenzoate
2-methoxy-4-[4-(3,4,5-trimethoxyphenyl)-hexahydrofuro[3,4-c]furan-1-yl]phenol
(8r,9s,10s)-3,4,19-trimethoxy-9,10-dimethyl-15,17-dioxatetracyclo[10.7.0.0²,⁷.0¹⁴,¹⁸]nonadeca-1(12),2,4,6,13,18-hexaene-5,8-diol
8-hydroxy-7-methyl-6-oxo-3-propyl-8,8a-dihydro-1h-isochromen-7-yl 4-hydroxy-2-methoxy-6-methylbenzoate
8-hydroxy-3,6,9-trimethylidene-2-oxo-octahydroazuleno[4,5-b]furan-4-yl 3-(acetyloxy)-2-methylidenebutanoate
(2s,4as,9s,10s,10ar)-6,9,10-trihydroxy-2,4a-dimethyl-1-methylidene-5,8-dioxo-7-(prop-2-en-1-yl)-4,9,10,10a-tetrahydro-3h-phenanthren-2-yl acetate
7-(acetyloxy)-9-methyl-3-methylidene-2-oxo-4,5,6a,7,9a,9b-hexahydro-3ah-spiro[azuleno[4,5-b]furan-6,2'-oxiran]-4-yl 2-methylbut-2-enoate
1-[2,4-dihydroxy-3-(3-hydroxy-2-methoxy-3-methylbutyl)-6-methoxyphenyl]-3-(4-hydroxyphenyl)propenone
{"Ingredient_id": "HBIN000645","Ingredient_name": "1-[2,4-dihydroxy-3-(3-hydroxy-2-methoxy-3-methylbutyl)-6-methoxyphenyl]-3-(4-hydroxyphenyl)propenone","Alias": "NA","Ingredient_formula": "C22H26O7","Ingredient_Smile": "CC(C)(C(CC1=C(C=C(C(=C1O)C(=O)C=CC2=CC=C(C=C2)O)OC)O)O)OC","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5910","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(2r-trans)2,3-dihydro-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-5-benzofuranpropanol acetate
{"Ingredient_id": "HBIN006558","Ingredient_name": "(2r-trans)2,3-dihydro-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-5-benzofuranpropanol acetate","Alias": "NA","Ingredient_formula": "C22H26O7","Ingredient_Smile": "CC(=O)OCCCC1=CC(=C2C(=C1)C(C(O2)C3=CC(=C(C=C3)O)OC)CO)OC","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5640","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3'-o-demethyldenudanolide b; 3',4'-di-me ether,5'-methoxy
{"Ingredient_id": "HBIN009310","Ingredient_name": "3'-o-demethyldenudanolide b; 3',4'-di-me ether,5'-methoxy","Alias": "NA","Ingredient_formula": "C22H26O7","Ingredient_Smile": "NA","Ingredient_weight": "0","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "8016","PubChem_id": "NA","DrugBank_id": "NA"}
(+)-4-hydroxy-2,6-di(3,4-dimethoxy)phenyl-3,7-dioxabicyclo[3.3.0]octane
{"Ingredient_id": "HBIN010438","Ingredient_name": "(+)-4-hydroxy-2,6-di(3,4-dimethoxy)phenyl-3,7-dioxabicyclo[3.3.0]octane","Alias": "NA","Ingredient_formula": "C22H26O7","Ingredient_Smile": "COC1=C(C=C(C=C1)C2C3COC(C3C(O2)O)C4=CC(=C(C=C4)OC)OC)OC","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "9994","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
binankadsurin a
{"Ingredient_id": "HBIN018520","Ingredient_name": "binankadsurin a","Alias": "NA","Ingredient_formula": "C22H26O7","Ingredient_Smile": "CC1CC2=CC(=C(C(=C2C3=C(C4=C(C=C3C(C1C)O)OCO4)OC)O)OC)OC","Ingredient_weight": "402.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "2381","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "16757190","DrugBank_id": "NA"}