equilin

PubChem Notes:

Equilin An estrogenic steroid produced by HORSES. It has a total of four double bonds in the A- and B-ring. High concentration of euilin is found in the URINE of pregnant mares.

Molecular Formula: C18H20O2


InChI: InChI=1/C18H20O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3-5,10,14,16,19H,2,6-9H2,1H3

InChIKey: InChIKey=WKRLQDKEXYKHJB-UHFFFAOYAG
SMILES: CC12CCC3C(=CCC4=C3C=CC(=C4)O)C1CCC2=O

Names:
    BRN 2624302
    Dihydroequilenin
    EINECS 207-488-6
    equilin
    Estra-1,3,5(10),7-tetraen-17-one, 3-hydroxy-
    NSC 10971
    1,3,5,7-Estratetraen-3-ol-17-one
    3-Hydroxyoestra-1,3,5(10),7-tetraen-17-one
    3-hydroxy-13-methyl-9,11,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-17-one
    4-08-00-01366 (Beilstein Handbook Reference)
    7-Dehydroestrone

Registries:
    PubChem CID 3247
    PubChem ID 153374