Exact Mass: 458.17207320000006
Exact Mass Matches: 458.17207320000006
Found 500 metabolites which its exact mass value is equals to given mass value 458.17207320000006
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
I-123 BMIPP
C1446 - Radiopharmaceutical Compound > C2124 - Radioconjugate Same as: D06608
Valechlorin
Constituent of Valeriana officinalis (valerian). Valechlorin is found in tea, fats and oils, and herbs and spices. Valechlorin is found in fats and oils. Valechlorin is a constituent of Valeriana officinalis (valerian). Valechlorin is an iridoid monoterpenoid.
Deoxynivalenol 3-glucoside
Deoxynivalenol 3-glucoside is found in cereals and cereal products. Deoxynivalenol 3-glucoside is isolated from cultures of sweet corn (Zea mays). Isolated from cultures of sweet corn (Zea mays). Deoxynivalenol 3-glucoside is found in cereals and cereal products and fats and oils.
Austinol
Austinol is a metabolite of Emericella nidulans, Emericella dentata, Aspergillus variecolor and Aspergillus ustu Metabolite of Emericella nidulans, Emericella dentata, Aspergillus variecolor and Aspergillus ustus.
Gein
Sasanquin is found in fats and oils. Sasanquin is isolated from leaves of Camellia sasanqua and Camellia japonica. Isolated from roots of Geum urbanum (herb bennet)
a-L-Fucopyranosyl-(1->2)-b-D-galactopyranosyl-(1->2)-D-xylose
a-L-Fucopyranosyl-(1->2)-b-D-galactopyranosyl-(1->2)-D-xylose is found in pulses. a-L-Fucopyranosyl-(1->2)-b-D-galactopyranosyl-(1->2)-D-xylose is a constituent in the cell wall material of scarlet runner bean (Phaseolus coccineus). Constituent in the cell wall material of scarlet runner bean (Phaseolus coccineus). a-L-Fucopyranosyl-(1->2)-b-D-galactopyranosyl-(1->2)-D-xylose is found in pulses.
3-Hydroxychavicol 1-[rhamnosyl-(1->6)-glucoside]
3-Hydroxychavicol 1-[rhamnosyl-(1->6)-glucoside] is found in herbs and spices. 3-Hydroxychavicol 1-[rhamnosyl-(1->6)-glucoside] is a constituent of rhizomes of Alpinia officinarum (lesser galangal). Constituent of rhizomes of Alpinia officinarum (lesser galangal). 3-Hydroxychavicol 1-[rhamnosyl-(1->6)-glucoside] is found in herbs and spices.
Eugenol O-[a-L-Arabinofuranosyl-(1->6)-b-D-glucopyranoside]
Eugenol O-[a-L-Arabinofuranosyl-(1->6)-b-D-glucopyranoside] is found in green vegetables. Eugenol O-[a-L-Arabinofuranosyl-(1->6)-b-D-glucopyranoside] is a constituent of Rosa damascena (damask rose). Constituent of Rosa damascena (damask rose). Eugenol O-[a-L-Arabinofuranosyl-(1->6)-b-D-glucopyranoside] is found in herbs and spices and green vegetables.
Fluprostenol
Lignan
Lorglumide
D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006727 - Hormone Antagonists C78276 - Agent Affecting Digestive System or Metabolism > C29701 - Anti-ulcer Agent C78272 - Agent Affecting Nervous System > C28197 - Antianxiety Agent
7-[2,5-Dihydroxy-2-[3-hydroxy-4-[3-(trifluoromethyl)phenoxy]but-1-enyl]cyclopentyl]hept-5-enoic acid
10,14-Dihydroxy-11-methoxy-3,3-dimethyl-12-(3-methyl-2-butenyl)-[1]benzopyrano[5,6-b]xanthen-13(3H)-one
MulberrosideC
Mulberroside C is a natural product found in Morus lhou, Morus wittiorum, and Morus alba with data available. Mulberroside C is one of the main bioactive constituents in mulberry (Morus alba L.)[1]. Mulberroside C is a HCV replicon inhibitor. Antiviral activity[2]. Mulberroside C is one of the main bioactive constituents in mulberry (Morus alba L.)[1]. Mulberroside C is a HCV replicon inhibitor. Antiviral activity[2].
7-Hydroxy-5,4-dimethoxy-8-methylisoflavone 7-O-rhamnoside
[3aS-[3aR*,4R*,5S*(Z),6S*,10Z,11aS*]]-2,3,3a,4,5,6,7,11a-Octahydro-10-(hydroxymethyl)-6-methyl-3-methylene-4-[(2-methyl-1-oxo-2-propenyl)oxy]-2,7-dioxo-6,9-epoxycyclodeca[b]furan-5-yl ester 2-methyl-2-butenoic acid
[3aS-(3aR*,4R*,5S*,6S*,10Z,11aS*)]-2,3,3a,4,5,6,7,11a-Octahydro-10-(hydroxymethyl)-6-methyl-3-methylene-4-[(2-methyl-1-oxo-2-propenyl)oxy]-2,7-dioxo-6,9-epoxycyclodeca[b]furan-5-yl ester 3-methyl-2-butenoic acid
15(S)-Fluprostenol
Benzyl glycoside,2-Ac-beta-Pyranose-3-O-alpha-L-Rhamnopyranosyl-D-galactose
8,9-Dihydro,8-hydroxy-Exiguaflavanone D|exiguaflavanone M
3,4,5,7-tetrahydroxy-6-[7-hydroxy-3,7-dimethyl-2(E)-octenyl]flavanone
8beta-<5-(4-hydroxytigloyl)-4-hydroxytigloyloxy>-kauniolide|8beta-[5-(4-hydroxytigloyl)-4-hydroxytigloyloxy]-kauniolide
8beta-<5-<4,5-dihydroxytigloyloxy>-tigloyloxy>-kauniolide|8beta-[5-(4,5-dihydroxytigloyloxy)-tigloyloxy]-kauniolide
rel-5-(3S,8S-dihydroxy-1R,5S-dimethyl-7-oxa-6-oxobicyclo[3,2,1]oct-8-yl)-3-methyl-2Z,4E-pentadienoic acid 3-O-beta-D-glucopyranoside
1-O-(6-O-alpha-L-rhamnopyranosyl-beta-D-glucopyranosyl)-2-hydroxy-4-allylbenzene|3,4-Dihydroxyallylbenzene 4-O-[??-L-rhamnopyranosyl-(1鈥樏傗垎6)]-??-D-glucopyranoside|demethyleugenol beta-rutinoside
Ligustrin-<5-O-(4-hydroxytigloyl)-4-hydroxy>-sarracinate|Ligustrin-[5-O-(4-hydroxytigloyl)-4-hydroxy]-sarracinate
(1R,2S,4S,5S,6R,7R,9S,10S)-1,9,15-triacetoxy-2,4,6-trihydroxy-8-oxodihydro-beta-agarofuran
(2E)-2-decene-4,6-diyne-1,8-diol 8-O-beta-D-apiofuranosyl-(1->6)-beta-D-glucopyranoside|(2E)-2-Decene-4,6-diyne-1,8-diol 8-O-??-D-apiofuranosyl-(1鈥樏傗垎6)-??-D-glucopyranoside
8beta-4-hydroxy-5-(tigloyloxy)-tigloyloxy-4beta,15-dihydro-3-dehydrozaluzanin C
desacetoxyzuubergenin-8beta-4-hydroxy-5-(5-hydroxysarracinoyl)-tiglate
8beta-5-(5-hydroxytigloyloxy)-tigloyloxy-3-dehydro-4beta,15-dihydro-zaluzanin C|8beta-5-<5-hydroxytigloyloxy>-tigloyloxy-3-dehydro-4beta,15-dihydro-zaluzanin C
4-allyl-2-methoxyphenyl 6-O-beta-D-apiofuranosyl-(1->6)-beta-D-glucopyranoside|4-allyl-2-methoxyphenyl-O-beta-D-apiosyl-(1->6)-beta-D-glucopyranoside
1-[2,3-trans-3,4-dihydroxy-2-(1,4-dihydroxy-1,5-dimethylhex-5-enyl)-2,3-dihydrobenzofuran-5-yl]-3-(4-hydroxyphenyl)-E-propenone|xanthokeismin C
8beta,9alpha-diangeloyloxy-14-oic-acanthospermolide
8beta,9alpha-diangeloyloxy-15-hydroxy-14-oxo-4,5-cis-acanthospermolide
1-O-(2-methoxy-4-acetylphenyl)-6-O-(E-cinnamoyl)-beta-D-glucopyranoside|scrophuloside C
4-Allyl-2-methoxyphenyl 6-O-beta-D-apiofuranosyl-(1->6)-beta-D-glucopyranoside
4-methoxy-cinnamyl-(6-O-alpha-L-arabinopyranosyl)-O-beta-D-glucopyranoside|4-methoxycinnamyl 6-O-(alpha-L-arabinopyranosyl)-beta-D-glucopyranoside
1-(beta-D-glucopyranosyloxybenzyl)-2-hydroxy-2-isopropyl-malate methyl ester
piperchabaoside A|trans-cinnamyl alcohol O-beta-D-glucopyranosyl-(1->4)-beta-D-glucopyranoside
1,6-dihydroxy-7-methoxy-8-(3-methyl-2-butenyl)-2,2-dimethylchromeno[5,6:2,3]xanthone
Ligustrin-<4-hydroxy-5-(5-hydroxytigloyloxy)-tiglate>
1-(4-beta-D-glucopyranosyloxybenzyl)-(2R)-2-isobutylmalate|4-{{[(2R)-2-(carboxymethyl)-2-hydroxy-4-methyl-1-oxopentyl]oxy}methyl}phnyl beta-D-glucopyranoside|gymnoside I
4-(4-beta-D-glucopyranosyloxybenzyl)-(2R)-2-isobutylmalanate|4-{{[(3R)-3-carboxy-3-hydroxy-5-methyl-1-oxohexyl]oxy}methyl}phenyl beta-D- glucopyranoside|gymnoside II
5-[2,3-epoxy-3-methylbutyl]-3-O-beta-D-xylopyranosyl-6,5-dihydroxy-2-phenylbenzofuran|moracinoside M
His Thr Ser Asp
Kadsurin
Kadsurin, (-)- is a tannin. It has a role as a metabolite. Kadsurin is a natural product found in Kadsura coccinea, Kadsura heteroclita, and other organisms with data available.
Geoside
Geoside is a natural product found in Salacia chinensis, Rhodiola rosea, and other organisms with data available.
2-(hydroxymethyl)-6-[[3,4,5-trihydroxy-6-(4-prop-2-enylphenoxy)oxan-2-yl]methoxy]oxane-3,4,5-triol
C25H30O8_3-Furancarboxylic acid, (3R,5S,5aS,6S,9aR)-octahydro-9-hydroxy-2,2,5a,9-tetramethyl-2H-3,9a-methano-1-benzoxepin-5,6-diyl ester
Deoxynivalenol 3-glucoside
D009676 - Noxae > D011042 - Poisons > D014255 - Trichothecenes D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins CONFIDENCE Reference Standard (Level 1)
Ala Cys Glu His
C17H26N6O7S (458.15836060000004)
Ala Cys His Glu
C17H26N6O7S (458.15836060000004)
Ala Glu Cys His
C17H26N6O7S (458.15836060000004)
Ala Glu His Cys
C17H26N6O7S (458.15836060000004)
Ala His Cys Glu
C17H26N6O7S (458.15836060000004)
Ala His Glu Cys
C17H26N6O7S (458.15836060000004)
Cys Ala Glu His
C17H26N6O7S (458.15836060000004)
Cys Ala His Glu
C17H26N6O7S (458.15836060000004)
Cys Glu Ala His
C17H26N6O7S (458.15836060000004)
Cys Glu His Ala
C17H26N6O7S (458.15836060000004)
Cys His Ala Glu
C17H26N6O7S (458.15836060000004)
Cys His Glu Ala
C17H26N6O7S (458.15836060000004)
Asp Gly His Met
C17H26N6O7S (458.15836060000004)
Asp Gly Met His
C17H26N6O7S (458.15836060000004)
Asp His Gly Met
C17H26N6O7S (458.15836060000004)
Asp His Met Gly
C17H26N6O7S (458.15836060000004)
Asp His Ser Thr
Asp His Thr Ser
Asp Met Gly His
C17H26N6O7S (458.15836060000004)
Asp Met His Gly
C17H26N6O7S (458.15836060000004)
Asp Met Pro Pro
Asp Asn Asn Pro
Asp Asn Pro Asn
Asp Pro Met Pro
Asp Pro Asn Asn
Asp Pro Pro Met
Asp Ser His Thr
Asp Ser Thr His
Asp Thr His Ser
Asp Thr Ser His
Glu Ala Cys His
C17H26N6O7S (458.15836060000004)
Glu Ala His Cys
C17H26N6O7S (458.15836060000004)
Glu Cys Ala His
C17H26N6O7S (458.15836060000004)
Glu Cys His Ala
C17H26N6O7S (458.15836060000004)
Glu His Ala Cys
C17H26N6O7S (458.15836060000004)
Glu His Cys Ala
C17H26N6O7S (458.15836060000004)
Glu His Ser Ser
Glu Ser His Ser
Glu Ser Ser His
Gly Asp His Met
C17H26N6O7S (458.15836060000004)
Gly Asp Met His
C17H26N6O7S (458.15836060000004)
Gly Gly Tyr Tyr
Gly His Asp Met
C17H26N6O7S (458.15836060000004)
Gly His Met Asp
C17H26N6O7S (458.15836060000004)
Gly Met Asp His
C17H26N6O7S (458.15836060000004)
Gly Met His Asp
C17H26N6O7S (458.15836060000004)
Gly Tyr Gly Tyr
Gly Tyr Tyr Gly
His Ala Cys Glu
C17H26N6O7S (458.15836060000004)
His Ala Glu Cys
C17H26N6O7S (458.15836060000004)
His Cys Ala Glu
C17H26N6O7S (458.15836060000004)
His Cys Glu Ala
C17H26N6O7S (458.15836060000004)
His Asp Gly Met
C17H26N6O7S (458.15836060000004)
His Asp Met Gly
C17H26N6O7S (458.15836060000004)
His Asp Ser Thr
His Asp Thr Ser
His Glu Ala Cys
C17H26N6O7S (458.15836060000004)
His Glu Cys Ala
C17H26N6O7S (458.15836060000004)
His Glu Ser Ser
His Gly Asp Met
C17H26N6O7S (458.15836060000004)
His Gly Met Asp
C17H26N6O7S (458.15836060000004)
His Met Asp Gly
C17H26N6O7S (458.15836060000004)
His Met Gly Asp
C17H26N6O7S (458.15836060000004)
His Ser Asp Thr
His Ser Glu Ser
His Ser Ser Glu
His Ser Thr Asp
His Thr Asp Ser
Met Asp Gly His
C17H26N6O7S (458.15836060000004)
Met Asp His Gly
C17H26N6O7S (458.15836060000004)
Met Asp Pro Pro
Met Gly Asp His
C17H26N6O7S (458.15836060000004)
Met Gly His Asp
C17H26N6O7S (458.15836060000004)
Met His Asp Gly
C17H26N6O7S (458.15836060000004)
Met His Gly Asp
C17H26N6O7S (458.15836060000004)
Met Pro Asp Pro
Met Pro Pro Asp
Asn Asp Asn Pro
Asn Asp Pro Asn
Asn Asn Asp Pro
Asn Asn Pro Asp
Asn Pro Asp Asn
Asn Pro Asn Asp
Pro Asp Met Pro
Pro Asp Asn Asn
Pro Asp Pro Met
Pro Met Asp Pro
Pro Met Pro Asp
Pro Asn Asp Asn
Pro Asn Asn Asp
Pro Pro Asp Met
Pro Pro Met Asp
Ser Asp His Thr
Ser Asp Thr His
Ser Glu His Ser
Ser Glu Ser His
Ser His Asp Thr
Ser His Glu Ser
Ser His Ser Glu
Ser His Thr Asp
Ser Ser Glu His
Ser Ser His Glu
Ser Thr Asp His
Ser Thr His Asp
Thr Asp His Ser
Thr Asp Ser His
Thr His Asp Ser
Thr His Ser Asp
Thr Ser Asp His
Thr Ser His Asp
Tyr Gly Gly Tyr
Tyr Gly Tyr Gly
Tyr Tyr Gly Gly
fluprostenol
D012102 - Reproductive Control Agents > D003270 - Contraceptive Agents D012102 - Reproductive Control Agents > D008186 - Luteolytic Agents C78568 - Prostaglandin Analogue
5-trans Fluprostenol
Austinol
A meroterpenoid produced by Aspergillus nidulans. It has a pentacyclic structure which incorporates three lactone functionalities and a spiro union.
3-Hydroxychavicol 1-[rhamnosyl-(1->6)-glucoside]
Eugenol O-[a-L-Arabinofuranosyl-(1->6)-b-D-glucopyranoside]
Valechlorin
a-L-Fucopyranosyl-(1->2)-b-D-galactopyranosyl-(1->2)-D-xylose
1,3-diisocyanato-2-methylbenzene,ethane-1,2-diol,hexanedioic acid,propane-1,2-diol
C20H30N2O10 (458.19003599999996)
4-[(2-Amino-1,3-benzothiazol-6-yl)amino]-6-methyl-7-[2-(1-piperid inyl)ethoxy]-3-quinolinecarbonitrile
C25H26N6OS (458.18887060000003)
2-[(2-cyanoethyl)[p-[(p-nitrophenyl)azo]phenyl]amino]ethyl carbanilate
ethyl 6-fluoro-1-(4-fluorophenyl)-7-[4-(2-hydroxyethyl)piperazin-1-yl]-4-oxo-1,8-naphthyridine-3-carboxylate
[(1R,2S,3R,4R,5R,6S)-3-benzoyloxy-4-butanoyloxy-2,5,6-trihydroxycyclohexyl] benzoate
ethane-1,2-diol,hexanedioic acid,1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene
5-(diisopropylamino)-2-[[4-(dimethylamino)phenyl]azo]-3-methyl-1,3,4-thiadiazolium methyl sulphate
4-[2-(1,3-dioxo-2-benzo[de]isoquinolinyl)ethyl]-N-(4-methylphenyl)-1-piperazinecarbothioamide
4-[2-[[3-(4-Methylphenyl)-5-triazolo[1,5-a]quinazolinyl]amino]ethyl]benzenesulfonamide
4-[(diethylamino)sulfonyl]-N-[1-(4,5-dimethyl-6-oxo-1,6-dihydropyrimidin-2-yl)-3-methyl-1H-pyrazol-5-yl]benzamide
C21H26N6O4S (458.17361560000006)
Trimethylsilyl 3,4,5-tris[(trimethylsilyl)oxy]benzoate
Iodofiltic acid (123I)
C1446 - Radiopharmaceutical Compound > C2124 - Radioconjugate
4-{[4-{[(1R,2R)-2-(dimethylamino)cyclopentyl]amino}-5-(trifluoromethyl)pyrimidin-2-yl]amino}-N-methylbenzenesulfonamide
(2s,4s,5r)-1-(4-Tert-Butylbenzoyl)-2-Isobutyl-5-(1,3-Thiazol-2-Yl)pyrrolidine-2,4-Dicarboxylic Acid
C24H30N2O5S (458.18753300000003)
N-[Isoleucinyl]-N-[adenosyl]-diaminosufone
C16H26N8O6S (458.16959360000004)
5-(4-Phenoxyphenyl)-5-(4-Pyrimidin-2-Ylpiperazin-1-Yl)pyrimidine-2,4,6(2h,3h)-Trione
(2S,3S)-2-amino-4-cyclopropyl-3-[(3R)-3-(2-fluoro-4-methylsulfonylphenyl)-1,2,4-oxadiazolidin-5-yl]-1-[(3S)-3-fluoropyrrolidin-1-yl]butan-1-one
2-(Hydroxymethyl)-6-[[3,4,5-trihydroxy-6-(4-prop-2-enylphenoxy)oxan-2-yl]methoxy]oxane-3,4,5-triol
(12R)-5-ethyl-12-(4-methoxyphenyl)-15,17-dimethyl-2,4,9,13-tetraoxatetracyclo[8.7.1.03,8.014,18]octadeca-1(17),14(18),15-triene-6,7,16-triol
O-methyl-4-O-[alpha-L-rhamnopyranosyl-(1->3)-2-O-methyl-alpha-L-rhamnopyranosyl]-hydroxybenzoate
10,14-Dihydroxy-11-methoxy-3,3-dimethyl-12-(3-methyl-2-butenyl)-[1]benzopyrano[5,6-b]xanthen-13(3H)-one
7-[2,5-Dihydroxy-2-[3-hydroxy-4-[3-(trifluoromethyl)phenoxy]but-1-enyl]cyclopentyl]hept-5-enoic acid
(+-)-chartaceone B
A dihydroxyflavanone that is flavanone substituted by hydroxy groups at positions 5 and 7 and a 6-carboxy-1-phenylhex-1-en-1-yl group at position 6. It has been isolated as a racemate from the bark of Cryptocarya chartacea.
rac-(6E)-5-(5,7-dihydroxy-4-oxo-2-phenyl-3,4-dihydro-2H-chromen-6-yl)-7-phenylhept-6-enoic acid
2-[[4-(4-methoxyphenyl)-5-(2-phenylethyl)-1,2,4-triazol-3-yl]thio]-N-(phenylmethyl)acetamide
2-[3-[(Z)-(3-cyclopentyl-4-oxo-2-phenylimino-1,3-thiazolidin-5-ylidene)methyl]-2-methylindol-1-yl]acetamide
11-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}-3-(2-methoxyethyl)-3,11-dihydro-4H-pyrimido[5,4:4,5]pyrrolo[2,3-b]quinoxalin-4-one
2-[(2R,4aS,12aR)-5-methyl-6-oxo-8-[(1-oxo-2-thiophen-2-ylethyl)amino]-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]acetic acid methyl ester
C23H26N2O6S (458.15114960000005)
(E)-7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(3R)-3-hydroxy-4-[3-(trifluoromethyl)phenoxy]but-1-enyl]cyclopentyl]hept-5-enoic acid
2-[(2S,4aR,12aS)-5-methyl-6-oxo-8-[(1-oxo-2-thiophen-2-ylethyl)amino]-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]acetic acid methyl ester
C23H26N2O6S (458.15114960000005)
N-[(2S,3R,6S)-6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-4-methylbenzenesulfonamide
C24H30N2O5S (458.18753300000003)
N-[(2S,3S,6S)-6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-4-methylbenzenesulfonamide
C24H30N2O5S (458.18753300000003)
N-[(2R,3R,6S)-6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)oxan-3-yl]-4-methylbenzenesulfonamide
C24H30N2O5S (458.18753300000003)
2-[(1S,3R,4aS,9aR)-1-(hydroxymethyl)-6-[(2-methoxy-1-oxoethyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(2-fluorophenyl)methyl]acetamide
2-[(1S,3S,4aR,9aS)-1-(hydroxymethyl)-6-[(2-methoxyacetyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b][1]benzofuran-3-yl]-N-[(2-fluorophenyl)methyl]acetamide
methyl 2-[(2R,4aR,12aR)-5-methyl-6-oxo-8-[(2-thiophen-2-ylacetyl)amino]-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]acetate
C23H26N2O6S (458.15114960000005)
N-[(2R,3S,6R)-6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-4-methylbenzenesulfonamide
C24H30N2O5S (458.18753300000003)
N-[(2R,3S,6S)-6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)oxan-3-yl]-4-methylbenzenesulfonamide
C24H30N2O5S (458.18753300000003)
N-[(2R,3R,6R)-6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)oxan-3-yl]-4-methylbenzenesulfonamide
C24H30N2O5S (458.18753300000003)
N-[(2S,3S,6R)-6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-4-methylbenzenesulfonamide
C24H30N2O5S (458.18753300000003)
2-[(1R,3S,4aS,9aR)-1-(hydroxymethyl)-6-[(2-methoxy-1-oxoethyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(2-fluorophenyl)methyl]acetamide
methyl 2-[(2S,4aS,12aR)-5-methyl-6-oxo-8-[(2-thiophen-2-ylacetyl)amino]-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]acetate
C23H26N2O6S (458.15114960000005)
2-[(2R,4aR,12aS)-5-methyl-6-oxo-8-[(1-oxo-2-thiophen-2-ylethyl)amino]-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]acetic acid methyl ester
C23H26N2O6S (458.15114960000005)
methyl 2-[(2R,4aS,12aS)-5-methyl-6-oxo-8-[(2-thiophen-2-ylacetyl)amino]-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]acetate
C23H26N2O6S (458.15114960000005)
N-[(2S,3R,6R)-6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-4-methylbenzenesulfonamide
C24H30N2O5S (458.18753300000003)
2-[(2S,4aS,12aS)-5-methyl-6-oxo-8-[(1-oxo-2-thiophen-2-ylethyl)amino]-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]acetic acid methyl ester
C23H26N2O6S (458.15114960000005)
[(3aS,4R,9bS)-1-(2-methylphenyl)sulfonyl-8-(2-phenylethynyl)-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-4-yl]methanol
C27H26N2O3S (458.1664046000001)
2-[(1S,3S,4aS,9aR)-1-(hydroxymethyl)-6-[(2-methoxy-1-oxoethyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(2-fluorophenyl)methyl]acetamide
2-[(1R,3S,4aR,9aS)-1-(hydroxymethyl)-6-[(2-methoxy-1-oxoethyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(2-fluorophenyl)methyl]acetamide
2-[(1R,3R,4aS,9aR)-1-(hydroxymethyl)-6-[(2-methoxy-1-oxoethyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(2-fluorophenyl)methyl]acetamide
2-[(1S,3R,4aR,9aS)-1-(hydroxymethyl)-6-[(2-methoxy-1-oxoethyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(2-fluorophenyl)methyl]acetamide
2-[(2S,4aR,12aR)-5-methyl-6-oxo-8-[(1-oxo-2-thiophen-2-ylethyl)amino]-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]acetic acid methyl ester
C23H26N2O6S (458.15114960000005)
[(3aR,4S,9bR)-1-(2-methylphenyl)sulfonyl-8-(2-phenylethynyl)-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-4-yl]methanol
C27H26N2O3S (458.1664046000001)
[(3aR,4R,9bR)-1-(2-methylphenyl)sulfonyl-8-(2-phenylethynyl)-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-4-yl]methanol
C27H26N2O3S (458.1664046000001)
[(3aS,4S,9bS)-1-(2-methylphenyl)sulfonyl-8-(2-phenylethynyl)-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-4-yl]methanol
C27H26N2O3S (458.1664046000001)
[(3aS,4R,9bS)-4-(hydroxymethyl)-8-(2-methoxyphenyl)-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-1-yl]-(1,3-benzodioxol-5-yl)methanone
C27H26N2O5 (458.18416260000004)
methyl (1R,9S,10S,11S)-10-(hydroxymethyl)-12-(3-methylphenyl)sulfonyl-6-oxo-5-[(E)-prop-1-enyl]-7,12-diazatricyclo[7.2.1.02,7]dodeca-2,4-diene-11-carboxylate
C23H26N2O6S (458.15114960000005)
methyl (1S,9R,10R,11R)-10-(hydroxymethyl)-12-(3-methylphenyl)sulfonyl-6-oxo-5-[(E)-prop-1-enyl]-7,12-diazatricyclo[7.2.1.02,7]dodeca-2,4-diene-11-carboxylate
C23H26N2O6S (458.15114960000005)
(2E)-2-[(2-fluorophenyl)methylidene]-4-[2-oxo-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-1,4-benzoxazin-3-one
C26H23FN4O3 (458.17540999999994)
Trimethylsilyl 2,4,6-tris[(trimethylsilyl)oxy]benzoate
lorglumide
D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006727 - Hormone Antagonists C78276 - Agent Affecting Digestive System or Metabolism > C29701 - Anti-ulcer Agent C78272 - Agent Affecting Nervous System > C28197 - Antianxiety Agent
2-(2-Methoxy-4-prop-2-enylphenoxy)-6-[(3,4,5-trihydroxyoxan-2-yl)oxymethyl]oxane-3,4,5-triol
(+-)-chartaceone A
A racemate composed of equimolar concentrations of chartaceone A1, A2, A3 and A4. It has been isolated from the barks of Cryptocarya chartacea.
chartaceone A
A dihydroxyflavanone that is flavanone substituted by hydroxy groups at positions 5 and 7 and a 6-carboxy-1-phenylhex-1-en-3-yl group at position 6.
Camlipixant
Camlipixant (BLU-5937) a potent, selective, non-competitive and orally active P2X3 homotrimeric receptor antagonist with an IC50 of 25 nM against hP2X3 homotrimeric. Camlipixant shows potent anti-tussive effect and no taste alteration. Camlipixant can be used for the research of unexplained, refractory chronic cough[1].
CC-90003
CC-90003 is an irreversible and selective inhibitor of ERK 1/2 with antitumor activity.
Quinine (sulfate hydrate)
Quinine sulfate hydrate (2:1:4) is an orally active alkaloid extracted from cinchona bark and can be used in anti-malarial studies. Quinine sulfate hydrate (2:1:4) is a potassium channel inhibitor that inhibits WT mouse Slo3 (KCa5.1) channel currents evoked by voltage pulses to +100?mV with an IC50 of 169 μM[1][2].
5-ethenyl-1-oxo-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3h,4h,4ah,5h,6h-pyrano[3,4-c]pyran-3-yl 2-methylbutanoate
[(3ar,4s,6as,9ar,9br)-4-[(4-hydroxy-2-methylidenebutanoyl)oxy]-3,6-dimethylidene-2-oxo-3ah,4h,5h,6ah,7h,9ah,9bh-azuleno[4,5-b]furan-9-yl]methyl (2z)-4-hydroxy-2-methylbut-2-enoate
7-hydroxy-9,14-dimethyl-8-[(2-methylbut-2-enoyl)oxy]-5-methylidene-4-oxo-3,13-dioxatetracyclo[8.4.0.0²,⁶.0¹²,¹⁴]tetradec-9-en-11-yl 2-methylbut-2-enoate
5-methoxy-3-(4-methoxyphenyl)-8-methyl-7-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}chromen-4-one
(1s,6s,7s,7as)-4-[(acetyloxy)methyl]-7-(chloromethyl)-7-hydroxy-1-[(3-methylbutanoyl)oxy]-1h,6h,7ah-cyclopenta[c]pyran-6-yl 3-methylbutanoate
2-hydroxy-4-[2-hydroxy-4-methoxy-6-(2-oxononyl)benzoyloxy]-6-methylbenzoic acid
21'-hydroxy-2',6',6',14',19'-pentamethyl-7',16',18'-trioxaspiro[oxirane-2,11'-pentacyclo[12.6.1.0²,¹².0⁵,¹⁰.0¹⁷,²¹]henicosane]-4',9'-diene-3',8',15',20'-tetrone
5,8,15,18-tetrahydroxy-1,11-bis(methylsulfanyl)-3,13-diazapentacyclo[11.7.0.0³,¹¹.0⁴,⁹.0¹⁴,¹⁹]icosane-2,12-dione
methyl (2r)-2-{[3-(2,3-dihydroxy-3-methylbutyl)-4-hydroxyphenyl]methyl}-4-hydroxy-3-(4-hydroxyphenyl)-5-oxofuran-2-carboxylate
(3r,4s)-3-[(2s,3r)-2,3-dimethyloxirane-2-carbonyloxy]-2,2-dimethyl-8-oxo-3h,4h-pyrano[3,2-g]chromen-4-yl (2s,3r)-2,3-dimethyloxirane-2-carboxylate
10,17-diethyl-1,12,16-trihydroxy-7,18-dimethoxy-4,11-dioxapentacyclo[10.8.0.0³,⁸.0⁹,¹³.0¹⁵,²⁰]icosa-3(8),6,15,17,19-pentaene-5,14-dione
3-hydroxy-5-methyl-3-{[(4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methoxy]carbonyl}hexanoic acid
2-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-[(10-hydroxydec-8-en-4,6-diyn-3-yl)oxy]oxane-3,4,5-triol
(3s,4as,5r,6s)-5-ethenyl-1-oxo-6-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3h,4h,4ah,5h,6h-pyrano[3,4-c]pyran-3-yl (2s)-2-methylbutanoate
4a,8-dimethyl-9-[(2-methylbut-2-enoyl)oxy]-3-methylidene-2,5-dioxo-3ah,4h,7ah,8h,9h,9ah-azuleno[6,5-b]furan-4-yl 2-(hydroxymethyl)but-2-enoate
13-(acetyloxy)-4,15-dimethyl-8-oxo-12-(3-oxoprop-1-en-2-yl)-3,7,17-trioxatetracyclo[12.2.1.1⁶,⁹.0²,⁴]octadeca-1(16),9(18),14-trien-10-yl acetate
(z,2z,4e)-4-(methoxyimino)-n-[(1e)-3-[(2e,4s,5r,7s,8r,10s)-4,8,14-trihydroxy-12-oxo-6,11-dioxatricyclo[11.4.0.0⁵,⁷]heptadeca-1(17),2,13,15-tetraen-10-yl]prop-1-en-1-yl]but-2-enimidic acid
(2e)-3-{[(3ar,4r,6ar,9s,9ar,9br)-9-methyl-3,6-dimethylidene-2,8-dioxo-octahydroazuleno[4,5-b]furan-4-yl]oxy}-2-ethylidene-3-oxopropyl (2e)-2-(hydroxymethyl)but-2-enoate
(2s,3r,4s,5s,6r)-2-[2-methoxy-4-(prop-2-en-1-yl)phenoxy]-6-({[(2s,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]oxy}methyl)oxane-3,4,5-triol
(5s)-5-[(2s)-5,7-dihydroxy-4-oxo-2-phenyl-2,3-dihydro-1-benzopyran-6-yl]-7-phenylhept-6-enoic acid
(1r,2s,12s,14r,15r,17s)-2,6,6,11,14,17-hexamethyl-8,18,19-trioxo-7,16,20-trioxapentacyclo[13.3.3.0¹,¹⁵.0²,¹².0⁵,¹⁰]henicosa-4,10-diene-14-carboxylic acid
(2r,3s,4s,5s)-2-{3-hydroxy-5-[(11r)-11-hydroxy-12,12-dimethyl-4,13-dioxatricyclo[7.4.0.0³,⁷]trideca-1(9),2,5,7-tetraen-5-yl]phenoxy}oxane-3,4,5-triol
5-methoxy-3-(4-methoxyphenyl)-8-methyl-7-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]chromen-4-one
(3ar,4s,6ar,8s,9ar,9br)-8-{[(2e)-4-hydroxy-2-methylbut-2-enoyl]oxy}-3,6,9-trimethylidene-2-oxo-octahydroazuleno[4,5-b]furan-4-yl (2e)-4-hydroxy-2-methylbut-2-enoate
2-[2-(4-{5-[2-(2,5-dihydroxyphenyl)ethyl]-2-hydroxyphenoxy}phenyl)ethyl]benzene-1,4-diol
(2r,3r,5s,6r)-2-({[(2r,3r,4r)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,5-dihydroxy-6-{[(2s)-4-(4-hydroxyphenyl)butan-2-yl]oxy}oxan-4-one
(2s,3r,5s,6z)-2,5-bis(acetyloxy)-7-[(2s,3s,4r)-3-(acetyloxy)-4-methoxy-6-oxooxan-2-yl]hept-6-en-3-yl acetate
(2s,3r,4s,5s,6r)-2-{2-methoxy-4-[(1e)-prop-1-en-1-yl]phenoxy}-6-({[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}methyl)oxane-3,4,5-triol
[(2s,3r,4r)-4-{[4-(acetyloxy)-3-methoxyphenyl]methyl}-2-(3,4-dimethoxyphenyl)oxolan-3-yl]methyl acetate
1-0一(6-O-a-L-rhamnopyranosy-β-D-glucopyranosyl)-2-hydroxy-4-allylbenzene
{"Ingredient_id": "HBIN000214","Ingredient_name": "1-0\u4e00(6-O-a-L-rhamnopyranosy-\u03b2-D-glucopyranosyl)-2-hydroxy-4-allylbenzene","Alias": "NA","Ingredient_formula": "C21H30O11","Ingredient_Smile": "CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(C=C(C=C3)CC=C)O)O)O)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "36608","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(2 e)-2-decene-4,6-diyne-1,8-diol 8-o-β-d-apio-furanosyl-(1→6)-β-d-glucopyranoside
{"Ingredient_id": "HBIN005544","Ingredient_name": "(2 e)-2-decene-4,6-diyne-1,8-diol 8-o-\u03b2-d-apio-furanosyl-(1\u21926)-\u03b2-d-glucopyranoside","Alias": "(2e)-2-decene-4,6-diyne-1,8-diol 8-o-\u03b2-d-apio-furanosyl-(1\u21926)-\u03b2-d-glucopyranoside","Ingredient_formula": "C21H30O11","Ingredient_Smile": "COC1=C(C=CC(=C1)CC=C)OC2C(C(C(C(O2)COC3C(C(CO3)(CO)O)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT14930","TCMID_id": "4841","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3,4-dihydroxyallylbenzene4-o-[α-l-rhamnopyranosyl-(1→6)]-β-d-glucopyranoside
{"Ingredient_id": "HBIN007384","Ingredient_name": "3,4-dihydroxyallylbenzene4-o-[\u03b1-l-rhamnopyranosyl-(1\u21926)]-\u03b2-d-glucopyranoside","Alias": "NA","Ingredient_formula": "C21H30O11","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5753","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
4-propenyl-2-methoxyphenyl6-o-β-d-apiofuranosyl(1→6)-β-d-glucopyranoside
{"Ingredient_id": "HBIN010831","Ingredient_name": "4-propenyl-2-methoxyphenyl6-o-\u03b2-d-apiofuranosyl(1\u21926)-\u03b2-d-glucopyranoside","Alias": "NA","Ingredient_formula": "C21H30O11","Ingredient_Smile": "COC1=C(C=CC(=C1)CC=C)OC2C(C(C(C(O2)COC3C(C(CO3)(CO)O)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "17908","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}