Estriol 16-glucuronide

(2S,3S,4S,5R,6R)-6-[[(8R,9S,13S,14S,16R,17R)-3,17-dihydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-16-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

Also Known As: 16-Glucuronide-estriol|Estriol 16-glucuronide|Estriol-16alpha-glucuronide|Estriol-16-glucosiduronate|Estriol-16-Glucuronide|Oestriol-16alpha-glucuronide|Estriol O16-glucuronide|Estriol 16-glucosiduronate|Estriol-16beta-D-glucopyranosiduronic acid|Estriol 16alpha-glucuronide|estriol-16 alpha-glucuronide|Estriol-16alpha-(beta-D-glucuronide)|Estriol 16|A-(|A-D-glucuronide)|Estriol 16-O-beta-D-Glucuronide|Estriol 16alpha-(beta-D-glucuronide)|estriol-16 alpha-glucosiduronate|Estriol 16?-(?-D-Glucuronide)|KST-1A8648|16alpha,17beta-Estriol 16-(beta-D-glucuronide)|Estriol 16|_-(|_-D-Glucuronide)|estriol-16 alpha-(beta-D-glucuronide)|NCGC00485340-01|Estriol 16|cent-(|?-D-glucuronide)|SID:134223444|Estriol 16 alpha -( beta -D-glucuronide)

Molecular Formula	C24H32O9
Molecular Weight	464.20462 g/mol
LogP	0.5
Topological Polar Surface Area	156.91 Ų
Hydrogen Bond Donors	6
Hydrogen Bond Acceptors	8
Rotatable Bonds	3
Exact Mass	464.20462
Heavy Atoms	33
Complexity	921.2

Chemical Identifiers

CAS Number	1852-50-2
SMILES	C[C@]12CC[C@H]3[C@H]([C@@H]1C[C@H]([C@@H]2O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O)CCC5=C3C=CC(=C5)O