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Decyl 11,17-dihydroxy-17-methyl-3-oxoandrosta-1,4-diene-2-carboxylate

HCID 162902
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Basic information

CAS
60023-91-8
Standard SMILES
CCCCCCCCCCOC(=O)C1=C[C@@]2(C)C(=CC1=O)CC[C@@H]1[C@@H]2[C@@H](O)C[C@@]2(C)[C@H]1CC[C@@]2(C)O
InChIKey
QAXZEBWVHGLRCX-JWHDWHCNSA-N
Molecular formula
C31H48O5
Average molar mass
500.72 g/mol
Monoisotopic mass
500.35017464

Names & identifiers

Preferred name
Decyl 11,17-dihydroxy-17-methyl-3-oxoandrosta-1,4-diene-2-carboxylate
IUPAC
Decyl 11beta,17alpha-dihydroxy-17beta-methyl-3-oxoandrosta-1,4-diene-2-carboxylate
English name
BR 917
Molecular formula
C31H48O5
Molecular weight
500.72

Names & synonyms

BR 917Decylroxibolone11β,17β-Dihydroxy-17-methyl-3-oxoandrosta-1,4-diene-2-carboxylic acid decyl esterAndrosta-1,4-diene-2-carboxylic acid, 11,17-dihydroxy-17-methyl-3-oxo-, decyl ester, (11β,17β)- (9CI)

Database identifiers

CAS
60023-91-8
PubChem CID
162902
DTXSID
DTXSID80975449

Properties

Physicochemical properties

Boiling point
628.9 · 628.9±55.0 °C(Predicted)
Density
1.12 · 1.12±0.1 g/cm3(Predicted)
pka
14.38 · 14.38±0.70(Predicted)

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