HIT ID: HIT100136462

Cas No: 1177-87-3

分子式: C24H31FO6

分子量: 434.504

常用名: Dexamethasone acetate

氢键受体数 (HBA): 5

氢键供体数 (HBD): 2

LogP: 2.322000000000000e+000

IUPAC: 2-[(1R,2R,3aS,3bS,9aS,9bR,10S,11aS)-9b-fluoro-1,10-dihydroxy-2,9a,11a-trimethyl-7-oxo-1H,2H,3H,3aH,3bH,4H,5H,7H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]-2-oxoethyl acetate

SMILES: C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)COC(C)=O |c:11,t:7|

InChI key: AKUJBENLRBOFTD-RPRRAYFGSA-N