Exact Mass: 476.20998180000004
Exact Mass Matches: 476.20998180000004
Found 500 metabolites which its exact mass value is equals to given mass value 476.20998180000004
,
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
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>
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
(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
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
1,7-bis(4-hydroxyphenyl)-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyheptan-3-one
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
Ala Cys Gln Arg
C17H32N8O6S (476.21654120000005)
Ala Cys Arg Gln
C17H32N8O6S (476.21654120000005)
Ala Met Gln Gln
C18H32N6O7S (476.20530820000005)
Ala Gln Cys Arg
C17H32N8O6S (476.21654120000005)
Ala Gln Met Gln
C18H32N6O7S (476.20530820000005)
Ala Gln Gln Met
C18H32N6O7S (476.20530820000005)
Ala Gln Arg Cys
C17H32N8O6S (476.21654120000005)
Ala Arg Cys Gln
C17H32N8O6S (476.21654120000005)
Ala Arg Gln Cys
C17H32N8O6S (476.21654120000005)
Cys Ala Gln Arg
C17H32N8O6S (476.21654120000005)
Cys Ala Arg Gln
C17H32N8O6S (476.21654120000005)
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 Ala Arg
C17H32N8O6S (476.21654120000005)
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 Arg Ala
C17H32N8O6S (476.21654120000005)
Cys Gln Val Gln
C18H32N6O7S (476.20530820000005)
Cys Arg Ala Gln
C17H32N8O6S (476.21654120000005)
Cys Arg Gln Ala
C17H32N8O6S (476.21654120000005)
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 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 Ile Asp
Glu Thr Leu Asp
Glu Thr Val Glu
Glu Val Glu Thr
Glu Val Thr Glu
Gly Met Asn Arg
C17H32N8O6S (476.21654120000005)
Gly Met Arg Asn
C17H32N8O6S (476.21654120000005)
Gly Asn Met Arg
C17H32N8O6S (476.21654120000005)
Gly Asn Arg Met
C17H32N8O6S (476.21654120000005)
Gly Arg Met Asn
C17H32N8O6S (476.21654120000005)
Gly Arg Asn Met
C17H32N8O6S (476.21654120000005)
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 His Pro Ser
His His Ser Pro
His Pro His Ser
His Pro Ser His
His Ser Ala Tyr
His Ser Phe Ser
His Ser His Pro
His Ser Pro His
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 Asp Glu Thr
Ile Asp Thr Glu
Ile Glu Asp Thr
Ile Glu Glu Ser
Ile Glu Ser Glu
Ile Glu Thr Asp
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)
Ile Ser Glu Glu
Ile Thr Asp Glu
Ile Thr Glu Asp
Leu Cys Asn Gln
C18H32N6O7S (476.20530820000005)
Leu Cys Gln Asn
C18H32N6O7S (476.20530820000005)
Leu Asp Glu Thr
Leu Asp Thr Glu
Leu Glu Asp Thr
Leu Glu Glu Ser
Leu Glu Ser Glu
Leu Glu Thr Asp
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)
Leu Ser Glu Glu
Leu Thr Asp Glu
Leu Thr Glu Asp
Met Ala Gln Gln
C18H32N6O7S (476.20530820000005)
Met Gly Asn Arg
C17H32N8O6S (476.21654120000005)
Met Gly Arg Asn
C17H32N8O6S (476.21654120000005)
Met Met Pro Val
Met Met Val Pro
Met Asn Gly Arg
C17H32N8O6S (476.21654120000005)
Met Asn Asn Val
C18H32N6O7S (476.20530820000005)
Met Asn Arg Gly
C17H32N8O6S (476.21654120000005)
Met Asn Val Asn
C18H32N6O7S (476.20530820000005)
Met Pro Met Val
Met Pro Val Met
Met Gln Ala Gln
C18H32N6O7S (476.20530820000005)
Met Gln Gln Ala
C18H32N6O7S (476.20530820000005)
Met Arg Gly Asn
C17H32N8O6S (476.21654120000005)
Met Arg Asn Gly
C17H32N8O6S (476.21654120000005)
Met Val Met Pro
Met Val Asn Asn
C18H32N6O7S (476.20530820000005)
Met Val Pro Met
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 Met Arg
C17H32N8O6S (476.21654120000005)
Asn Gly Arg Met
C17H32N8O6S (476.21654120000005)
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 Gly Arg
C17H32N8O6S (476.21654120000005)
Asn Met Asn Val
C18H32N6O7S (476.20530820000005)
Asn Met Arg Gly
C17H32N8O6S (476.21654120000005)
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 Arg Gly Met
C17H32N8O6S (476.21654120000005)
Asn Arg Met Gly
C17H32N8O6S (476.21654120000005)
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 His His Ser
Pro His Ser His
Pro Met Met Val
Pro Met Val Met
Pro Ser His His
Pro Val Met Met
Gln Ala Cys Arg
C17H32N8O6S (476.21654120000005)
Gln Ala Met Gln
C18H32N6O7S (476.20530820000005)
Gln Ala Gln Met
C18H32N6O7S (476.20530820000005)
Gln Ala Arg Cys
C17H32N8O6S (476.21654120000005)
Gln Cys Ala Arg
C17H32N8O6S (476.21654120000005)
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 Arg Ala
C17H32N8O6S (476.21654120000005)
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 Arg Ala Cys
C17H32N8O6S (476.21654120000005)
Gln Arg Cys Ala
C17H32N8O6S (476.21654120000005)
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
Arg Ala Cys Gln
C17H32N8O6S (476.21654120000005)
Arg Ala Gln Cys
C17H32N8O6S (476.21654120000005)
Arg Cys Ala Gln
C17H32N8O6S (476.21654120000005)
Arg Cys Gln Ala
C17H32N8O6S (476.21654120000005)
Arg Gly Met Asn
C17H32N8O6S (476.21654120000005)
Arg Gly Asn Met
C17H32N8O6S (476.21654120000005)
Arg Met Gly Asn
C17H32N8O6S (476.21654120000005)
Arg Met Asn Gly
C17H32N8O6S (476.21654120000005)
Arg Asn Gly Met
C17H32N8O6S (476.21654120000005)
Arg Asn Met Gly
C17H32N8O6S (476.21654120000005)
Arg Gln Ala Cys
C17H32N8O6S (476.21654120000005)
Arg Gln Cys Ala
C17H32N8O6S (476.21654120000005)
Ser Ala His Tyr
Ser Ala Asn Trp
Ser Ala Trp Asn
Ser Ala Tyr His
Ser Glu Glu Ile
Ser Glu Glu Leu
Ser Glu Leu Glu
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 His Pro
Ser His Pro His
Ser His Ser Phe
Ser His Tyr Ala
Ser Ile Glu Glu
Ser Leu Glu Glu
Ser Asn Ala Trp
Ser Asn Trp Ala
Ser Pro His His
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 Asp Glu Ile
Thr Asp Glu Leu
Thr Asp Ile Glu
Thr Asp Leu Glu
Thr Glu Asp Ile
Thr Glu Asp Leu
Thr Glu Glu Val
Thr Glu Ile Asp
Thr Glu Leu Asp
Thr Glu Val Glu
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 Ile Asp Glu
Thr Ile Glu Asp
Thr Leu Asp Glu
Thr Leu Glu Asp
Thr Asn Gly Trp
Thr Asn Trp Gly
Thr Val Glu 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 Glu Glu Thr
Val Met Met Pro
Val Met Asn Asn
C18H32N6O7S (476.20530820000005)
Val Met Pro Met
Val Asn Met Asn
C18H32N6O7S (476.20530820000005)
Val Asn Asn Met
C18H32N6O7S (476.20530820000005)
Val Pro Met Met
Val Gln Cys Gln
C18H32N6O7S (476.20530820000005)
Val Gln Gln Cys
C18H32N6O7S (476.20530820000005)
Val Thr Glu Glu
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
ST 19:4;O3;GlcA
D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones
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)-
Gutolactone
A quassinoid isolated from Simaba guianensis and has been shown to exhibit antimalarial activity.
8-[[4-(Furan-2-carbonyl)piperazin-1-yl]methyl]-1,3-dimethyl-7-[(2-methylphenyl)methyl]purine-2,6-dione
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
N-(2-adamantyl)-4-(4-ethylsulfonyl-1-piperazinyl)-3-nitrobenzamide
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
(2S)-2-[(4R,5S)-5-[[(2-fluorophenyl)methyl-methylamino]methyl]-4-methyl-1,1-dioxo-8-[(E)-prop-1-enyl]-4,5-dihydro-3H-6,1lambda6,2-benzoxathiazocin-2-yl]propan-1-ol
C25H33FN2O4S (476.21449500000006)
(2R)-2-[(4S,5S)-5-[[cyclopropylmethyl(methyl)amino]methyl]-8-(4-fluorophenyl)-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-2-yl]-1-propanol
C25H33FN2O4S (476.21449500000006)
2-[(2R,3S,6S)-3-[[[(3,5-dimethyl-4-isoxazolyl)amino]-oxomethyl]amino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]-N-(4-phenylphenyl)acetamide
2-[(2R,3R,6S)-3-[[[(3,5-dimethyl-4-isoxazolyl)amino]-oxomethyl]amino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]-N-(4-phenylphenyl)acetamide
2-[(2R,3R,6R)-3-[[[(3,5-dimethyl-4-isoxazolyl)amino]-oxomethyl]amino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]-N-(4-phenylphenyl)acetamide
(2S,3S,3aR,9bR)-3-(hydroxymethyl)-N2-[2-(1-methyl-4-imidazolyl)ethyl]-6-oxo-N1-phenyl-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-1,2-dicarboxamide
N-[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]methanesulfonamide
N-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]methanesulfonamide
N-[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]methanesulfonamide
N-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]methanesulfonamide
N-[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]methanesulfonamide
(2R)-2-[(4R,5S)-5-[[(3-fluorophenyl)methyl-methylamino]methyl]-4-methyl-1,1-dioxo-8-[(E)-prop-1-enyl]-4,5-dihydro-3H-6,1lambda6,2-benzoxathiazocin-2-yl]propan-1-ol
C25H33FN2O4S (476.21449500000006)
(2R)-2-[(4R,5S)-5-[[(2-fluorophenyl)methyl-methylamino]methyl]-4-methyl-1,1-dioxo-8-[(E)-prop-1-enyl]-4,5-dihydro-3H-6,1lambda6,2-benzoxathiazocin-2-yl]propan-1-ol
C25H33FN2O4S (476.21449500000006)
(2S)-2-[(4R,5R)-5-[[cyclopropylmethyl(methyl)amino]methyl]-8-(4-fluorophenyl)-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-2-yl]-1-propanol
C25H33FN2O4S (476.21449500000006)
(2R)-2-[(4S,5R)-5-[[cyclopropylmethyl(methyl)amino]methyl]-8-(4-fluorophenyl)-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-2-yl]-1-propanol
C25H33FN2O4S (476.21449500000006)
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
(2R,3R,3aS,9bS)-3-(hydroxymethyl)-N2-[2-(1-methyl-4-imidazolyl)ethyl]-6-oxo-N1-phenyl-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-1,2-dicarboxamide
[(8R,9S,10R)-6-(2-methylphenyl)sulfonyl-9-(4-phenylphenyl)-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol
C28H32N2O3S (476.21335220000003)
[3-[2,3-dihydroxypropoxy(hydroxy)phosphoryl]oxy-2-hydroxypropyl] (4Z,7Z,10Z,13Z)-hexadeca-4,7,10,13-tetraenoate
C22H37O9P (476.21750820000005)
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.
(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"}