Dexamethasone-21-sulfobenzoate
Molecular Formula:
C29H33FO9S
InChI: InChI=1/C29H33FO9S/c1-16-11-22-21-8-7-18-13-19(31)9-10-26(18,2)28(21,30)23(32)14-27(22,3)29(16,35)24(33)15-39-25(34)17-5-4-6-20(12-17)40(36,37)38/h4-6,9-10,12-13,16,21-23,32,35H,7-8,11,14-15H2,1-3H3,(H,36,37,38)/t16-,21+,22+,23+,26+,27+,28+,29+/m1/s1/f/h36H
InChIKey: InChIKey=TWQWRHIQRAZHPR-VZSAOZCDDM
SMILES: CC1CC2C3CCC4=CC(=O)C=CC4(C3(C(CC2(C1(C(=O)COC(=O)C5=CC(=CC=C5)S(=O)(=O)O)O)C)O)F)C
Names:
Dexamethasone 21-(sodium 3-sulphobenzoate)
Dexamethasone-21-sulfobenzoate
EINECS 241-057-3
16978-57-7
3-[2-[(8S,9S,10S,11S,13S,14S,16R,17R)-9-fluoro-11,17-dihydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxo-ethoxy]carbonylbenzenesulfonic acid
Registries:
PubChem CID 63046
PubChem ID 205233
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