sodium 2,3,4-trimethoxy-13-methyl-17-sulfonatooxy-6,7,11,12,14,15,16,17-octahydrocyclopenta[a]phenanthrene

Molecular Formula: C21H27NaO7S


InChI: InChI=1/C21H28O7S.Na/c1-21-10-9-12-13(16(21)7-8-18(21)28-29(22,23)24)5-6-14-15(12)11-17(25-2)20(27-4)19(14)26-3;/h11,16,18H,5-10H2,1-4H3,(H,22,23,24);/q;+1/p-1/fC21H27O7S.Na/q-1;m

InChIKey: InChIKey=XSXZXMBCJCZSKF-LNLXBVKCCH
SMILES: CC12CCC3=C(C1CCC2OS(=O)(=O)[O-])CCC4=C(C(=C(C=C43)OC)OC)OC.[Na+]

Names:
    sodium 2,3,4-trimethoxy-13-methyl-17-sulfonatooxy-6,7,11,12,14,15,16,17-octahydrocyclopenta[a]phenanthrene
    2,3,4-TRIMETHOXY ESTRA-1,3,5(10),8-TETRAENE-17B-OL, HEMISULFATE ESTER, SODIUM SA
    23257-46-7

Registries:
    PubChem CID 31780
    PubChem ID 173829