Estradiol-17alpha

Molecular Formula: C₁₈H₂₄O₂

InChI: InChI=1/C18H24O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-17,19-20H,2,4,6-9H2,1H3/t14-,15-,16+,17-,18+/m1/s1

InChIKey: InChIKey=VOXZDWNPVJITMN-SFFUCWETBJ
SMILES: [H][C@]12CC[C@]3(C)[C@H](O)CC[C@@]3([H])[C@]1([H])CCc4cc(O)ccc24

CAS number 57-91-0

Names:
    Estradiol-17alpha
    estradiol-17α
    estra-1,3,5(10)trien-3,17alpha-diol
    ZINC03815415
    α-estradiol
    (8S,9S,13S,14S,17R)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol
    17alpha-Estradiol
    17alpha-estradiol

Registries:
    PubChem CID 68570
    Beilstein =2698044
    CAS 57-91-0 (from NIST)
    ChEBI 17160
    Gmelin 2190991
    Kegg C02537
    PubChem ID 12146107
    PubChem ID 5544