Paricalcitol

Molecular Formula: C27H44O3


InChI: InChI=1/C27H44O3/c1-18(8-9-19(2)26(3,4)30)24-12-13-25-21(7-6-14-27(24,25)5)11-10-20-15-22(28)17-23(29)16-20/h8-11,18-19,22-25,28-30H,6-7,12-17H2,1-5H3/b9-8+,21-11+/t18-,19+,22-,23-,24-,25+,27-/m1/s1

InChIKey: InChIKey=BPKAHTKRCLCHEA-UBFJEZKGBX
SMILES: [H]C1(CCC2(C(C1=CC=C3CC(CC(C3)O)O)CCC2C(C)C=CC(C)C(C)(C)O)C)[H]

Names:
    C08127
    Paricalcitol
    (1S,3S)-5-[(2E)-2-[(1R,3aR,7aR)-1-[(E,2S,5S)-6-hydroxy-5,6-dimethyl-hept-3-en-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]cyclohexane-1,3-diol
    131918-61-1
    19-Nor-1alpha,25-dihydroxyvitamin D2

Registries:
    PubChem CID 5281104
    PubChem ID 10327