Molecular Identity
Hydrocortisone Acetate
[2-[(8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
PubChem CID: 5744
Cortisol 21-acetate is a tertiary alpha-hydroxy ketone and a cortisol ester.
2D Structure
Properties
C23H32O6
Molecular Formula
404.50
Molecular Weight
g/mol
404.2199
Exact Mass
Da
2.2
XLogP
Drug-like (Lipinski: < 5)
101
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
6
H-Bond Acceptors
786
Complexity
SMILES
Canonical SMILES
SMILES: CC(=O)OCC(=O)C1(CCC2C1(CC(C3C2CCC4=CC(=O)CCC34C)O)C)OIsomeric SMILES
SMILES: CC(=O)OCC(=O)[C@]1(CC[C@@H]2[C@@]1(C[C@@H]([C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)O)C)OSynonyms(20)
hydrocortisone acetate50-03-3Cortisol 21-acetateHydrocortisone 21-acetateCortellCortef acetateCortisol acetateCortifoamLanacortCarmol HCDricortMicort-hcHemsol-HCOrabase HCAU-CORT
Data from PubChem (NCBI)
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Trials and conditions connected to Hydrocortisone Acetate
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