Molecular Identity
hydrocortisone butyrate
[(8S,9S,10R,11S,13S,14S,17R)-11-hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl] butanoate
PubChem CID: 26133
Cortisol 17-butyrate is cortisol esterified with butyric acid at the 17-hydroxy group. It has a role as a dermatologic drug and a drug allergen. It is a primary alpha-hydroxy ketone, a cortisol ester and a butyrate ester.
2D Structure
Properties
C25H36O6
Molecular Formula
432.50
Molecular Weight
g/mol
432.2512
Exact Mass
Da
3.2
XLogP
Drug-like (Lipinski: < 5)
101
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
6
H-Bond Acceptors
817
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
hydrocortisone butyrateHydrocortisone 17-butyrate13609-67-1Cortisol 17-butyrateHydrocortisone-17-butyrateLocoidHydrocortisone-17alpha-butyrateLocoid Lipocream17-O-butyrylcortisolH-17-BDTXSID404589605RMF7YPWN11beta,17,21-Trihydroxypregn-4-ene-3,20-dione 17-butyrateCHEBI:31674NSC-758433
Data from PubChem (NCBI)
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Trials and conditions connected to hydrocortisone butyrate
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