Exact Mass: 476.1994348
Exact Mass Matches: 476.1994348
Found 500 metabolites which its exact mass value is equals to given mass value 476.1994348
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
2-Methoxyestrone 3-glucuronide
2-Methoxyestrone 3-glucuronide belongs to the class of organic compounds known as steroid glucuronide conjugates. These are sterol lipids containing a glucuronide moiety linked to the steroid skeleton. Thus, 2-methoxyestrone 3-glucuronide is considered to be a steroid conjugate lipid molecule. 2-Methoxyestrone 3-glucuronide is a very hydrophobic molecule, practically insoluble (in water), and relatively neutral. 2-Methoxyestrone 3-glucuronide is a natural human metabolite of 2-methoxyestrone generated in the liver by UDP glucuronosyltransferase. 2-Methoxyestrone is a metabolite of 2-hydroxyestrone (a nonuterotrophic metabolite of estradiol). Glucuronidation is used to assist in the excretion of toxic substances, drugs, or other substances that cannot be used as an energy source. Glucuronic acid is attached via a glycosidic bond to the substance, and the resulting glucuronide, which has a much higher water solubility than the original substance, is eventually excreted by the kidneys. 2-Methoxyestrone 3-glucuronide is a natural human metabolite of 2-Methoxyestrone generated in the liver by UDP glucuonyltransferase. A glucuronide conjugate of 2-methodxyestrone formed by UDP-glucuronylstransferase (UTP). 2-methoxyestrone is a metabolite of 2-hydroxyestrone (a nonuterotrophic metabolite of estradiol) D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones
Vemlidy
1-[1-(2,4-dihydroxyphenyl)-9-(2-dimethylaminoethyl)-2-hydroxy-2,3-dihydro-1H-3a-azacyclopenta[a]inden-1-yl]benzene-3,4,5-triol|yuremamine
9alpha-(2,3-epoxy-2-methylbutyryloxy)-divaricatolide-8-O-(2R,3R-epoxy-2-methylbutyrate)|9alpha-<2,3-epoxy-2-methylbutyryloxy>-divaricatolide-8-O-<2R,3R-epoxy-2-methylbutyrate>
3,4,5-trimethoxyphenol D-apio-beta-D-furanosyl-(1->6)-beta-D-glucopyronoside
cordyceamide B|N-benzoyl-L-tyrosinyl-L-p-hydroxyphenylalaninol acetate
9alpha-angeloyloxy-2alpha-hydroxy-divaricatolide-8-O-<2S,3S-epoxy-2-methylbutyrate>
(2R*,3S*,4R*,6R*,7R*,8R*,10R*,11R*,14S*)-3-angelyloxy-9-hydroxy-14-(3-hydroxy-3-methylbutanoyloxy)-14,15-epoxytrix-5(15)-en-4,12-olide
9beta-hydroxy-1beta,8beta-di-(2,3-epoxy-2-methylbutyryloxy)-6-epi-alpha-cyclocostunolide|9beta-hydroxy-1beta,8beta-di-<2,3-epoxy-2-methylbutyryloxy>-6-epi-alpha-cyclocostunolide
8beta-<5-(4,5-dihydroxytigloyloxy)-tigloyloxy>-nobilin
2-(3-hydroxy-4-methoxyphenyl)ethanol 1-O-[alpha-L-rhamnopiranosyl-(1?2)-beta-D-glucopyranoside]
4-Me ether,3-O-alpha-L-rhamnopyranosyl-2-(3,4-Dihydroxyphenyl)ethyl beta-D-glucopy-ranoside
(S)-4-ethyl-4-hexanoyloxy-9-methoxy-1,12-dihydro-4H-pyrano[3,4:6,7]indolizino[1,2-b]quinoline-3,14-dione|20-Hexanoyl-10-methoxy-camptothecin|O-hexanoyl-10-methoxy-camptothecin
(2R,3R)-2,3-dihydro-3-hydroxymethyl-7-methoxy-2-(3-methoxy-4-alpha-L-rhamnopyranosyloxyphenyl)-5-benxofuranpropanol
10alpha-hydroxy-8beta-<5-(4-hydroxytigloyl)-4-hydroxytigloyloxy>-guaia-3,11(13)-dien-12,6alpha-olide|10alpha-hydroxy-8beta-[5-(4-hydroxytigloyl)-4-hydroxytigloyloxy]-guaia-3,11(13)-dien-12,6alpha-olide
2-methoxy-4-(1-hydroxyethyl)phenol 1-O-alpha-rhamnopyranosyl-(1->6)-beta-D-glucopyranoside
(-)-4-[beta-D-glucopyranosyl-(1->3)-beta-D-glucopyranosyloxy]benzyl ethyl ether
3-desacetyl-5-(4-hydroxytigloyloxy)-eupaformosanin
Val Glu Thr Glu
Ser Glu Ile Glu
1,7-bis(4-hydroxyphenyl)-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyheptan-3-one
C26H28N4O5_1H-Imidazo[1,2-a]indole-9-propanoic acid, 2,3,9,9a-tetrahydro-9-hydroxy-2-(2-methylpropyl)-3-oxo-alpha-(4-oxo-3(4H)-quinazolinyl)-, methyl ester
C21H32O12_Butanoic acid, 3-methyl-, (1aS,1bS,5S,5aS,6S,6aS)-2-[(beta-D-glucopyranosyloxy)methyl]-1a,1b,5,5a,6,6a-hexahydro-6-hydroxy-6-(hydroxymethyl)oxireno[3,4]cyclopenta[1,2-c]pyran-5-yl ester
1,7-bis(4-hydroxyphenyl)-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyheptan-3-one
[(1aS,1bS,5S,5aS,6S)-6-hydroxy-6-(hydroxymethyl)-2-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-1b,5,5a,6a-tetrahydro-1aH-oxireno[3,4]cyclopenta[1,3-d]pyran-5-yl] 3-methylbutanoate
1,7-bis(4-hydroxyphenyl)-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyheptan-3-one [IIN-based: Match]
1,7-bis(4-hydroxyphenyl)-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyheptan-3-one [IIN-based on: CCMSLIB00000845973]
1,7-bis(4-hydroxyphenyl)-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyheptan-3-one_major
[(1aS,1bS,5S,5aS,6S)-6-hydroxy-6-(hydroxymethyl)-2-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-1b,5,5a,6a-tetrahydro-1aH-oxireno[3,4]cyclopenta[1,3-d]pyran-5-yl] 3-methylbutanoate_major
[(1aS,1bS,5S,5aS,6S)-6-hydroxy-6-(hydroxymethyl)-2-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-1b,5,5a,6a-tetrahydro-1aH-oxireno[3,4]cyclopenta[1,3-d]pyran-5-yl] 3-methylbutanoate_53.3\\%
[(1aS,1bS,5S,5aS,6S)-6-hydroxy-6-(hydroxymethyl)-2-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-1b,5,5a,6a-tetrahydro-1aH-oxireno[3,4]cyclopenta[1,3-d]pyran-5-yl] 3-methylbutanoate_49.0\\%
Ala His Ser Tyr
Ala His Tyr Ser
Ala Met Gln Gln
C18H32N6O7S (476.20530820000005)
Ala Asn Ser Trp
Ala Asn Trp Ser
Ala Gln Met Gln
C18H32N6O7S (476.20530820000005)
Ala Gln Gln Met
C18H32N6O7S (476.20530820000005)
Ala Ser His Tyr
Ala Ser Asn Trp
Ala Ser Trp Asn
Ala Ser Tyr His
Ala Trp Asn Ser
Ala Trp Ser Asn
Ala Tyr His Ser
Ala Tyr Ser His
Cys Ile Asn Gln
C18H32N6O7S (476.20530820000005)
Cys Ile Gln Asn
C18H32N6O7S (476.20530820000005)
Cys Leu Asn Gln
C18H32N6O7S (476.20530820000005)
Cys Leu Gln Asn
C18H32N6O7S (476.20530820000005)
Cys Asn Ile Gln
C18H32N6O7S (476.20530820000005)
Cys Asn Leu Gln
C18H32N6O7S (476.20530820000005)
Cys Asn Gln Ile
C18H32N6O7S (476.20530820000005)
Cys Asn Gln Leu
C18H32N6O7S (476.20530820000005)
Cys Gln Ile Asn
C18H32N6O7S (476.20530820000005)
Cys Gln Leu Asn
C18H32N6O7S (476.20530820000005)
Cys Gln Asn Ile
C18H32N6O7S (476.20530820000005)
Cys Gln Asn Leu
C18H32N6O7S (476.20530820000005)
Cys Gln Gln Val
C18H32N6O7S (476.20530820000005)
Cys Gln Val Gln
C18H32N6O7S (476.20530820000005)
Cys Val Gln Gln
C18H32N6O7S (476.20530820000005)
Asp Glu Ile Thr
Asp Glu Leu Thr
Asp Glu Thr Ile
Asp Glu Thr Leu
Asp Ile Glu Thr
Asp Ile Thr Glu
Asp Leu Glu Thr
Asp Leu Thr Glu
Asp Thr Glu Ile
Asp Thr Glu Leu
Asp Thr Ile Glu
Asp Thr Leu Glu
Glu Asp Ile Thr
Glu Asp Leu Thr
Glu Asp Thr Ile
Glu Asp Thr Leu
Glu Glu Ile Ser
Glu Glu Leu Ser
Glu Glu Ser Ile
Glu Glu Ser Leu
Glu Glu Thr Val
Glu Glu Val Thr
Glu Ile Asp Thr
Glu Ile Glu Ser
Glu Ile Ser Glu
Glu Ile Thr Asp
Glu Leu Asp Thr
Glu Leu Glu Ser
Glu Leu Ser Glu
Glu Leu Thr Asp
Glu Met Pro Thr
Glu Met Thr Pro
Glu Pro Met Thr
Glu Pro Thr Met
Glu Ser Glu Ile
Glu Ser Glu Leu
Glu Ser Ile Glu
Glu Ser Leu Glu
Glu Thr Asp Ile
Glu Thr Asp Leu
Glu Thr Glu Val
Glu Thr Met Pro
Glu Thr Pro Met
Phe His Ser Ser
Phe Ser His Ser
Phe Ser Ser His
Gly His Thr Tyr
Gly His Tyr Thr
Gly Asn Thr Trp
Gly Asn Trp Thr
Gly Gln Ser Trp
Gly Gln Trp Ser
Gly Ser Gln Trp
Gly Ser Trp Gln
Gly Thr His Tyr
Gly Thr Asn Trp
Gly Thr Trp Asn
Gly Thr Tyr His
Gly Trp Asn Thr
Gly Trp Gln Ser
Gly Trp Ser Gln
Gly Trp Thr Asn
Gly Tyr His Thr
Gly Tyr Thr His
His Ala Ser Tyr
His Ala Tyr Ser
His Phe Ser Ser
His Gly Thr Tyr
His Gly Tyr Thr
His Ser Ala Tyr
His Ser Phe Ser
His Ser Ser Phe
His Ser Tyr Ala
His Thr Gly Tyr
His Thr Tyr Gly
His Tyr Ala Ser
His Tyr Gly Thr
His Tyr Ser Ala
His Tyr Thr Gly
Ile Cys Asn Gln
C18H32N6O7S (476.20530820000005)
Ile Cys Gln Asn
C18H32N6O7S (476.20530820000005)
Ile Asn Cys Gln
C18H32N6O7S (476.20530820000005)
Ile Asn Gln Cys
C18H32N6O7S (476.20530820000005)
Ile Gln Cys Asn
C18H32N6O7S (476.20530820000005)
Ile Gln Asn Cys
C18H32N6O7S (476.20530820000005)
Leu Cys Asn Gln
C18H32N6O7S (476.20530820000005)
Leu Cys Gln Asn
C18H32N6O7S (476.20530820000005)
Leu Asn Cys Gln
C18H32N6O7S (476.20530820000005)
Leu Asn Gln Cys
C18H32N6O7S (476.20530820000005)
Leu Gln Cys Asn
C18H32N6O7S (476.20530820000005)
Leu Gln Asn Cys
C18H32N6O7S (476.20530820000005)
Met Ala Gln Gln
C18H32N6O7S (476.20530820000005)
Met Glu Pro Thr
Met Glu Thr Pro
Met Asn Asn Val
C18H32N6O7S (476.20530820000005)
Met Asn Val Asn
C18H32N6O7S (476.20530820000005)
Met Pro Glu Thr
Met Pro Thr Glu
Met Gln Ala Gln
C18H32N6O7S (476.20530820000005)
Met Gln Gln Ala
C18H32N6O7S (476.20530820000005)
Met Thr Glu Pro
Met Thr Pro Glu
Met Val Asn Asn
C18H32N6O7S (476.20530820000005)
Asn Ala Ser Trp
Asn Ala Trp Ser
Asn Cys Ile Gln
C18H32N6O7S (476.20530820000005)
Asn Cys Leu Gln
C18H32N6O7S (476.20530820000005)
Asn Cys Gln Ile
C18H32N6O7S (476.20530820000005)
Asn Cys Gln Leu
C18H32N6O7S (476.20530820000005)
Asn Gly Thr Trp
Asn Gly Trp Thr
Asn Ile Cys Gln
C18H32N6O7S (476.20530820000005)
Asn Ile Gln Cys
C18H32N6O7S (476.20530820000005)
Asn Leu Cys Gln
C18H32N6O7S (476.20530820000005)
Asn Leu Gln Cys
C18H32N6O7S (476.20530820000005)
Asn Met Asn Val
C18H32N6O7S (476.20530820000005)
Asn Met Val Asn
C18H32N6O7S (476.20530820000005)
Asn Asn Met Val
C18H32N6O7S (476.20530820000005)
Asn Asn Val Met
C18H32N6O7S (476.20530820000005)
Asn Gln Cys Ile
C18H32N6O7S (476.20530820000005)
Asn Gln Cys Leu
C18H32N6O7S (476.20530820000005)
Asn Gln Ile Cys
C18H32N6O7S (476.20530820000005)
Asn Gln Leu Cys
C18H32N6O7S (476.20530820000005)
Asn Ser Ala Trp
Asn Ser Trp Ala
Asn Thr Gly Trp
Asn Thr Trp Gly
Asn Val Met Asn
C18H32N6O7S (476.20530820000005)
Asn Val Asn Met
C18H32N6O7S (476.20530820000005)
Asn Trp Ala Ser
Asn Trp Gly Thr
Asn Trp Ser Ala
Asn Trp Thr Gly
Pro Glu Met Thr
Pro Glu Thr Met
Pro Met Glu Thr
Pro Met Thr Glu
Pro Thr Glu Met
Pro Thr Met Glu
Gln Ala Met Gln
C18H32N6O7S (476.20530820000005)
Gln Ala Gln Met
C18H32N6O7S (476.20530820000005)
Gln Cys Ile Asn
C18H32N6O7S (476.20530820000005)
Gln Cys Leu Asn
C18H32N6O7S (476.20530820000005)
Gln Cys Asn Ile
C18H32N6O7S (476.20530820000005)
Gln Cys Asn Leu
C18H32N6O7S (476.20530820000005)
Gln Cys Gln Val
C18H32N6O7S (476.20530820000005)
Gln Cys Val Gln
C18H32N6O7S (476.20530820000005)
Gln Gly Ser Trp
Gln Gly Trp Ser
Gln Ile Cys Asn
C18H32N6O7S (476.20530820000005)
Gln Ile Asn Cys
C18H32N6O7S (476.20530820000005)
Gln Leu Cys Asn
C18H32N6O7S (476.20530820000005)
Gln Leu Asn Cys
C18H32N6O7S (476.20530820000005)
Gln Met Ala Gln
C18H32N6O7S (476.20530820000005)
Gln Met Gln Ala
C18H32N6O7S (476.20530820000005)
Gln Asn Cys Ile
C18H32N6O7S (476.20530820000005)
Gln Asn Cys Leu
C18H32N6O7S (476.20530820000005)
Gln Asn Ile Cys
C18H32N6O7S (476.20530820000005)
Gln Asn Leu Cys
C18H32N6O7S (476.20530820000005)
Gln Gln Ala Met
C18H32N6O7S (476.20530820000005)
Gln Gln Cys Val
C18H32N6O7S (476.20530820000005)
Gln Gln Met Ala
C18H32N6O7S (476.20530820000005)
Gln Gln Val Cys
C18H32N6O7S (476.20530820000005)
Gln Ser Gly Trp
Gln Ser Trp Gly
Gln Val Cys Gln
C18H32N6O7S (476.20530820000005)
Gln Val Gln Cys
C18H32N6O7S (476.20530820000005)
Gln Trp Gly Ser
Gln Trp Ser Gly
Ser Ala His Tyr
Ser Ala Asn Trp
Ser Ala Trp Asn
Ser Ala Tyr His
Ser Phe His Ser
Ser Phe Ser His
Ser Gly Gln Trp
Ser Gly Trp Gln
Ser His Ala Tyr
Ser His Phe Ser
Ser His Ser Phe
Ser His Tyr Ala
Ser Asn Ala Trp
Ser Asn Trp Ala
Ser Gln Gly Trp
Ser Gln Trp Gly
Ser Ser Phe His
Ser Ser His Phe
Ser Trp Ala Asn
Ser Trp Gly Gln
Ser Trp Asn Ala
Ser Trp Gln Gly
Ser Tyr Ala His
Ser Tyr His Ala
Thr Glu Met Pro
Thr Glu Pro Met
Thr Gly His Tyr
Thr Gly Asn Trp
Thr Gly Trp Asn
Thr Gly Tyr His
Thr His Gly Tyr
Thr His Tyr Gly
Thr Met Glu Pro
Thr Met Pro Glu
Thr Asn Gly Trp
Thr Asn Trp Gly
Thr Pro Glu Met
Thr Pro Met Glu
Thr Trp Gly Asn
Thr Trp Asn Gly
Thr Tyr Gly His
Thr Tyr His Gly
Val Cys Gln Gln
C18H32N6O7S (476.20530820000005)
Val Met Asn Asn
C18H32N6O7S (476.20530820000005)
Val Asn Met Asn
C18H32N6O7S (476.20530820000005)
Val Asn Asn Met
C18H32N6O7S (476.20530820000005)
Val Gln Cys Gln
C18H32N6O7S (476.20530820000005)
Val Gln Gln Cys
C18H32N6O7S (476.20530820000005)
Trp Ala Asn Ser
Trp Ala Ser Asn
Trp Gly Asn Thr
Trp Gly Gln Ser
Trp Gly Ser Gln
Trp Gly Thr Asn
Trp Asn Ala Ser
Trp Asn Gly Thr
Trp Asn Ser Ala
Trp Asn Thr Gly
Trp Gln Gly Ser
Trp Gln Ser Gly
Trp Ser Ala Asn
Trp Ser Gly Gln
Trp Ser Asn Ala
Trp Ser Gln Gly
Trp Thr Gly Asn
Trp Thr Asn Gly
Tyr Ala His Ser
Tyr Ala Ser His
Tyr Gly His Thr
Tyr Gly Thr His
Tyr His Ala Ser
Tyr His Gly Thr
Tyr His Ser Ala
Tyr His Thr Gly
Tyr Ser Ala His
Tyr Ser His Ala
Tyr Thr Gly His
Tyr Thr His Gly
ST 19:4;O3;GlcA
D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones
Tenofovir alafenamide
J - Antiinfectives for systemic use > J05 - Antivirals for systemic use > J05A - Direct acting antivirals > J05AF - Nucleoside and nucleotide reverse transcriptase inhibitors C471 - Enzyme Inhibitor > C1589 - Reverse Transcriptase Inhibitor > C97452 - Nucleoside Reverse Transcriptase Inhibitor C254 - Anti-Infective Agent > C281 - Antiviral Agent
7-Anilino-3-diethylamino-6-methyl fluoran
C31H28N2O3 (476.20998180000004)
3-Methyl-6-(methylpropylamino)-2-(phenylamino)fluoran
C31H28N2O3 (476.20998180000004)
Pentanoic acid, 4-(((1,1-biphenyl)-4-ylcarbonyl)amino)-5-((2-(4-fluorophenyl)-1,1-dimethylethyl)amino)-5-oxo-, (4S)-
1H-Pyrazolo(4,3-d)pyrimidine-3-carboxamide, 1-(2-ethoxyethyl)-5-(ethylmethylamino)-7-((4-methyl-2-pyridinyl)amino)-N-(methylsulfonyl)
C20H28N8O4S (476.19541280000004)
Gutolactone
A quassinoid isolated from Simaba guianensis and has been shown to exhibit antimalarial activity.
METHYLDOPA SESQUIHYDRATE
C20H32N2O11 (476.20060019999994)
D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D013565 - Sympatholytics D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D000322 - Adrenergic Agonists C78274 - Agent Affecting Cardiovascular System > C270 - Antihypertensive Agent D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents C78272 - Agent Affecting Nervous System > C66884 - Dopamine Agonist
4-methoxy-17-oxoestra-1,3,5(10)-trien-3-yl beta-D-glucopyranosiduronic acid
Norcaesalpinin D
A diterpenoid isolated from the seed kernels of Caesalpinia crista that has been found to exhibit antimalarial activity.
N-[(Z)-3-[3-(dimethylamino)propylamino]-1-[5-(3-nitrophenyl)furan-2-yl]-3-oxoprop-1-en-2-yl]-4-methylbenzamide
Ethyl 3-(2-chlorophenyl)-3-[(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)amino]propanoate
C22H29ClN6O4 (476.19387040000004)
1-[(3,4-Dimethoxyphenyl)-[1-(thiophen-2-ylmethyl)-5-tetrazolyl]methyl]-4-phenylpiperazine
N-(2-adamantyl)-4-(4-ethylsulfonyl-1-piperazinyl)-3-nitrobenzamide
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-N-[(E)-(4-propan-2-yloxyphenyl)methylideneamino]triazole-4-carboxamide
1-[[1-(1,3-Benzodioxol-5-ylmethyl)-5-tetrazolyl]-(2-fluorophenyl)methyl]-4-(2-furanylmethyl)piperazine
2-[(3S,6aS,8S,10aS)-1-[(4-chlorophenyl)methyl]-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(3-fluorophenyl)methyl]acetamide
N-[(2R,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]methanesulfonamide
N-[(2S,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]methanesulfonamide
2-[(2R,3S,6S)-3-[[[(3,5-dimethyl-4-isoxazolyl)amino]-oxomethyl]amino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]-N-(4-phenylphenyl)acetamide
2-[(2R,3R,6S)-3-[[[(3,5-dimethyl-4-isoxazolyl)amino]-oxomethyl]amino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]-N-(4-phenylphenyl)acetamide
2-[(2R,3R,6R)-3-[[[(3,5-dimethyl-4-isoxazolyl)amino]-oxomethyl]amino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]-N-(4-phenylphenyl)acetamide
2-[(3R,6aS,8S,10aS)-1-[(4-chlorophenyl)methyl]-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(3-fluorophenyl)methyl]acetamide
N-[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]methanesulfonamide
N-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]methanesulfonamide
N-[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]methanesulfonamide
N-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]methanesulfonamide
N-[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]methanesulfonamide
2-[(2S,3R,6R)-3-[[[(3,5-dimethyl-4-isoxazolyl)amino]-oxomethyl]amino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]-N-(4-phenylphenyl)acetamide
2-[(2R,3S,6R)-3-[[[(3,5-dimethyl-4-isoxazolyl)amino]-oxomethyl]amino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]-N-(4-phenylphenyl)acetamide
2-[(2S,3S,6R)-3-[[[(3,5-dimethyl-4-isoxazolyl)amino]-oxomethyl]amino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]-N-(4-phenylphenyl)acetamide
2-[(2S,3S,6S)-3-[[[(3,5-dimethyl-4-isoxazolyl)amino]-oxomethyl]amino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]-N-(4-phenylphenyl)acetamide
2-methoxyestrone 3-O-(beta-D-glucuronide)
A steroid glucosiduronic acid that is 2-methoxyestrone having a single beta-D-glucuronic acid residue attached at position 3.
MT-7716 hydrochloride
MT-7716 hydrochloride (W-212393 hydrochloride) is a selective non-peptide nociceptin receptor (NOP) agonist and promising potential treatment drug for alcohol abuse and relapse prevention[1].
(1s,4ar,5s,6r,6as,11as,11bs)-1,6-bis(acetyloxy)-4a-hydroxy-4,4,11b-trimethyl-7-oxo-1h,2h,3h,5h,6h,6ah,11h,11ah-phenanthro[3,2-b]furan-5-yl acetate
4,5,17-trihydroxy-6,14,18-trimethyl-9,16-dioxo-3,10-dioxapentacyclo[9.8.0.0¹,⁷.0⁴,¹⁹.0¹³,¹⁸]nonadec-14-en-12-yl 3-methylbut-2-enoate
(1r,4ar,6r,7s,7ar)-7-hydroxy-4,7-bis(hydroxymethyl)-6-{[(2e)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-1-yl (3s)-3-methylpentanoate
1,7-bis(4-hydroxyphenyl)-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}heptan-3-one
(1s,4as,6s,7r,7as)-6,7-dihydroxy-4-(hydroxymethyl)-7-({[(2e)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}methyl)-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-1-yl (3s)-3-methylpentanoate
2-(hydroxymethyl)-6-({3,11,17-trihydroxytricyclo[12.3.1.1²,⁶]nonadeca-1(18),2(19),3,5,14,16-hexaen-9-yl}oxy)oxane-3,4,5-triol
(1r,4ar,6r,7s,7ar)-7-hydroxy-4,7-bis(hydroxymethyl)-6-{[(2z)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-1-yl (3s)-3-methylpentanoate
6-(2,3-dimethyloxirane-2-carbonyloxy)-5-hydroxy-5a,9-dimethyl-3-methylidene-2-oxo-3ah,4h,5h,6h,7h,9ah,9bh-naphtho[1,2-b]furan-4-yl 2,3-dimethyloxirane-2-carboxylate
(1r,5r,6s,8s,9s,10s,13s,14r,15s)-8-hydroxy-5-{[(2r,3s)-3-hydroxy-2-methylbutanoyl]oxy}-10-methyl-11-oxo-4,12-dioxapentacyclo[7.7.0.0¹,⁶.0²,¹³.0¹⁰,¹⁵]hexadec-2-en-14-yl (2z)-2-methylbut-2-enoate
(3as,4s,5s,5ar,6s,7s,9as,9bs)-6,7-dihydroxy-5a,9-dimethyl-5-{[(2z)-2-methylbut-2-enoyl]oxy}-3-methylidene-2-oxo-3ah,4h,5h,6h,7h,9ah,9bh-naphtho[1,2-b]furan-4-yl (2s,3s)-2,3-dimethyloxirane-2-carboxylate
(3as,4s,5s,5ar,6s,7s,9as,9bs)-6,7-dihydroxy-5a,9-dimethyl-5-{[(2z)-2-methylbut-2-enoyl]oxy}-3-methylidene-2-oxo-3ah,4h,5h,6h,7h,9ah,9bh-naphtho[1,2-b]furan-4-yl (2r,3r)-2,3-dimethyloxirane-2-carboxylate
1β-hydroxyleudesma- 4, 11-dien-3-one
{"Ingredient_id": "HBIN002415","Ingredient_name": "1\u03b2-hydroxyleudesma- 4, 11-dien-3-one","Alias": "NA","Ingredient_formula": "C25H32O9","Ingredient_Smile": "CC1=CC(C(C2(C1C(C3C45C2C(C(C(=C)C4CC(=O)O3)O)(OC5)O)OC(=O)C=C(C)C)C)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "41911","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(2R,3R,4S,5R,6S)-3-isopropyl-2-methylol-6-(phenoxy)-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-tetrahydropyran-3,4,5-triol
{"Ingredient_id": "HBIN006433","Ingredient_name": "(2R,3R,4S,5R,6S)-3-isopropyl-2-methylol-6-(phenoxy)-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-tetrahydropyran-3,4,5-triol","Alias": "(2R,3R,4S,5R,6S)-2-(hydroxymethyl)-3-isopropyl-6-(phenoxy)-5-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]tetrahydropyran-3,4,5-triol; (2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-(phenoxy)-3-propan-2-yl-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-3,4,5-triol; 134515-66-5; (2R,3R,4S,5R,6S)-2-(hydroxymethyl)-3-isopropyl-6-(phenoxy)-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-3,4,5-triol; (2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-(phenoxy)-3-propan-2-yl-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-oxane-3,4,5-triol","Ingredient_formula": "C21H32O12","Ingredient_Smile": "CC(C)C1(C(OC(C(C1O)(O)OC2C(C(C(C(O2)CO)O)O)O)OC3=CC=CC=C3)CO)O","Ingredient_weight": "476.47","OB_score": "3.006463945","CAS_id": "134515-66-5","SymMap_id": "SMIT10107","TCMID_id": "NA","TCMSP_id": "MOL008896","TCM_ID_id": "NA","PubChem_id": "179289","DrugBank_id": "NA"}