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Estradiol 17-O-glucuronide

PropertiesImage
MNX_IDMNXM1594067 Image of MNXM1594067
referencevmhM:estrdl17glcur
vmhM:estrdl17glcur
formulaC24H31O8
global charge-1
mol weight447.504
InChIKeyMTKNDAQYHASLID-DNMLJSFZSA-M
InChIInChI=1S/C24H32O8/c1-24-9-8-14-13-5-3-12(25)10-11(13)2-4-15(14)16(24)6-7-17(24)31-23-20(28)18(26)19(27)21(32-23)22(29)30/h3,5,10,14-21,23,25-28H,2,4,6-9H2,1H3,(H,29,30)/p-1/t14-,15-,16+,17+,18+,19+,20-,21+,23+,24+/m1/s1
SMILESC[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1CC[C@@H]2O[C@H]1O[C@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@H]1O
MNX internals
InChI (mnx)InChI=1/C24H32O8/c1-24-9-8-14-13-5-3-12(25)10-11(13)2-4-15(14)16(24)6-7-17(24)31-23-20(28)18(26)19(27)21(32-23)22(29)30/h3,5,10,14-21,23,25-28H,2,4,6-9H2,1H3,(H,29,30)/t14-,15-,16+,17+,18+,19+,20-,21+,23+,24+/m1/s1 Image of MNXM1594067
SMILES (mnx)[CH3:1][C@:24]12[CH2:9][CH2:8][C@@H:14]3[c:13]4[cH:5][cH:3][c:12]([OH:25])[cH:10][c:11]4[CH2:2][CH2:4][C@H:15]3[C@@H:16]1[CH2:6][CH2:7][C@@H:17]2[O:31][C@@H:23]1[C@H:20]([OH:28])[C@@H:18]([OH:26])[C@H:19]([OH:27])[C@@H:21]([C:22]([OH:29])=[O:30])[O:32]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)4
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

vmhM:estrdl17glcur
vmhM:estrdl17glcur
vmhmetabolite:estrdl17glcur
vmhmetabolite:estrdl17glcur
MTKNDAQYHASLID-DNMLJSFZSA-M 		Estradiol 17-O-glucuronide
17 beta-Estradiol glucuronide
17-b-Estradiol glucuronide
17-beta-estradiol glucuronide
17beta-Estradiol-17-(beta-D-glucuronide)
Betaestradiol 17-(beta-D-glucuronide)
Cell signaling agent
Cellular membrane
Cytoplasma
Digestion
Estradiol-17 beta-glucuronide
Estradiol-17 beta-glucuronide, monosodium salt
Estradiol-17beta-D-glucuronide
Estradiol-17beta-glucuronide
Extracellular region
Fauna
Kidneys
Lipid metabolic process
Liver tissue
Membrane integrity agent
Membrane stability agent
Oestradiol-17beta-glucuronide
Signal transduction
Signaling agent
Signalling molecule
Surface-active agent
beta-Estradiol 17-beta-D-glucuronide
e(2)17g CPD
e217g CPD

vmhM:M_estrdl17glcur 		secondary/obsolete/fantasy identifier