Ees-17

Molecular Formula: C₂₀H₂₄O₅S

InChI: InChI=1/C20H24O5S/c1-3-20(25-26(22,23)24)11-9-18-17-6-4-13-12-14(21)5-7-15(13)16(17)8-10-19(18,20)2/h1,5,7,12,16-18,21H,4,6,8-11H2,2H3,(H,22,23,24)/t16-,17-,18+,19+,20+/m1/s1/f/h22H

InChIKey: InChIKey=JHKCCDZKVDAGJH-UOCIXUMZDK
SMILES: CC12CCC3C(C1CCC2(C#C)OS(=O)(=O)O)CCC4=C3C=CC(=C4)O

Names:
    Ees-17
    Ethinylestradiol-17-sulfate
    Ethinyl estradiol-17-sulfate
    Ethynyl estradiol 17-sulfate
    (8S,9S,13S,14S,17S)-17-ethynyl-3-hydroxy-13-methyl-17-sulfooxy-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene
    19-Norpregna-1,3,5(10)-trien-20-yne-3,17-diol, 17-(hydrogen sulfate), (17alpha)-
    75803-36-0

Registries:
    PubChem CID 67091
    PubChem ID 209201