4-Hydroxyestradiol 17-sulfate

Molecular Formula: C18H24O6S


InChI: InChI=1/C18H24O6S/c1-18-9-8-11-10-4-6-15(19)17(20)13(10)3-2-12(11)14(18)5-7-16(18)24-25(21,22)23/h4,6,11-12,14,16,19-20H,2-3,5,7-9H2,1H3,(H,21,22,23)/t11-,12-,14+,16+,18+/m1/s1/f/h21H

InChIKey: InChIKey=OFRQUXUVUJJDSU-CGXVKCSUDT
SMILES: CC12CCC3C(C1CCC2OS(=O)(=O)O)CCC4=C3C=CC(=C4O)O

Names:
    Estra-1,3,5(10)-triene-3,4,17-triol, 17-(hydrogen sulfate), (17bta)-
    (8S,9S,13S,14S,17S)-3,4-dihydroxy-13-methyl-17-sulfooxy-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene
    4-Hydroxyestradiol 17-sulfate
    4-OH-E2-17-S
    90746-92-2

Registries:
    PubChem CID 67372
    PubChem ID 209483