16alpha-Bromoacetoxyestradiol-3-methyl ether

Molecular Formula: C21H27BrO4


InChI: InChI=1/C21H27BrO4/c1-21-8-7-15-14-6-4-13(25-2)9-12(14)3-5-16(15)17(21)10-18(20(21)24)26-19(23)11-22/h4,6,9,15-18,20,24H,3,5,7-8,10-11H2,1-2H3/t15-,16-,17+,18-,20+,21+/m1/s1

InChIKey: InChIKey=WXFJKUDDKZJIRY-ORJOSYTKBV
SMILES: CC12CCC3C(C1CC(C2O)OC(=O)CBr)CCC4=C3C=CC(=C4)OC

Names:
    Estra-1,3,5(10)-triene-16,17-diol, 3-methoxy-, 16-(bromoacetate), (16alpha,17beta)-
    16alpha-Bromoacetoxyestradiol-3-methyl ether
    57456-71-0
    [(8R,9S,13S,14S,16R,17S)-17-hydroxy-3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-16-yl] 2-bromoacetate

Registries:
    PubChem CID 66404
    PubChem ID 208487