Predocol

Molecular Formula: C₂₈H₃₁NaO₉S

InChI: InChI=1/C28H32O9S.Na/c1-26-10-8-18(29)13-17(26)6-7-20-21-9-11-28(33,27(21,2)14-22(30)24(20)26)23(31)15-37-25(32)16-4-3-5-19(12-16)38(34,35)36;/h3-5,8,10,12-13,20-22,24,30,33H,6-7,9,11,14-15H2,1-2H3,(H,34,35,36);/q;+1/p-1/fC28H31O9S.Na/q-1;m

InChIKey: InChIKey=RWFZSORKWFPGNE-UCWDLWAMCM
SMILES: CC12CC(C3C(C1CCC2(C(=O)COC(=O)C4=CC(=CC=C4)S(=O)(=O)[O-])O)CCC5=CC(=O)C=CC35C)O.[Na+]

Names:
    Cortico-Sol
    EINECS 211-141-4
    Predenema
    Predfoam
    Prednisolone methylsulfobenzoate
    Prednisolone sodium metasulfobenzoate
    PREDNISOLONE SODIUM 21-M-SULFOBENZOATE
    Prednisolone 21-(3-sodium-sulphobenzoate)
    Predocol
    sodium 3-[2-(11,17-dihydroxy-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl)-2-oxo-ethoxy]carbonylbenzenesulfonate
    36570-50-0

Registries:
    PubChem CID 12421
    PubChem ID 155745