17alpha-Ethynylestradiol-17beta-D-glucopyranosiduronic acid

Molecular Formula: C26H32O8


InChI: InChI=1/C26H32O8/c1-3-26(34-24-21(30)19(28)20(29)22(33-24)23(31)32)11-9-18-17-6-4-13-12-14(27)5-7-15(13)16(17)8-10-25(18,26)2/h1,5,7,12,16-22,24,27-30H,4,6,8-11H2,2H3,(H,31,32)/t16u,17u,18u,19-,20-,21+,22-,24-,25-,26?/m0/s1/f/h31H

InChIKey: InChIKey=SQQXJBRONRGLRT-IBOMDCKDDY
SMILES: CC12CCC3C(C1CCC2(C#C)OC4C(C(C(C(O4)C(=O)O)O)O)O)CCC5=C3C=CC(=C5)O

Names:
    beta-D-Glucopyranosiduronic acid, (17alpha)-3-hydroxy-19-norpregna-1,3,5(10)-trien-20-yn-17-yl
    (2S,3S,4S,5R,6S)-6-[[(13S)-17-ethynyl-3-hydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]oxy]-3,4,5-trihydroxy-oxane-2-carboxylic acid
    17alpha-Ethynylestradiol-17beta-D-glucopyranosiduronic acid
    17-Eegp
    75803-39-3

Registries:
    PubChem CID 67092
    PubChem ID 209202