Glucuronosylestradiol

Molecular Formula: C₂₄H₃₁O₈^-

InChI: 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)/p-1/t14-,15-,16+,17+,18+,19+,20-,21+,23-,24+/m1/s1/fC24H31O8/q-1

InChIKey: InChIKey=MTKNDAQYHASLID-YBLUMRJJDN
SMILES: CC12CCC3C(C1CCC2OC4C(C(C(C(O4)C(=O)[O-])O)O)O)CCC5=C3C=CC(=C5)O

Names:
    C11237
    Estradiol-17beta-glucuronide
    Glucuronosylestradiol
    (2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(8S,9S,13S,14S,17S)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]oxy]oxane-2-carboxylate
    17beta-Estradiol 17-(beta-D-glucuronide)
    1806-98-0

Registries:
    PubChem CID 443090
    PubChem ID 13416