Alfadolone acetate

[2-[(3R,5S,8S,9S,10S,13S,14S,17S)-3-hydroxy-10,13-dimethyl-11-oxo-1,2,3,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate

CAS: 23930-37-2

Molecular Formula	`C23H34O5`
Molecular Weight	390.5 g/mol
LogP	3.2
Topological Polar Surface Area	80.7 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	5
Rotatable Bonds	4
Exact Mass	390.24063
Heavy Atoms	28
Complexity	686.0

Chemical Identifiers

CAS Number	23930-37-2
SMILES	`CC(=O)OCC(=O)C1CCC2C1(CC(=O)C3C2CCC4C3(CCC(C4)O)C)C`
InChIKey	`QRJOQYLXZPQQMX-FWROMSNXSA-N`

📖 Product Overview

Alfadolone acetate (CAS: 23930-37-2) is a chemical compound with molecular formula C23H34O5 and molecular weight 390.5 g/mol. Its IUPAC systematic name is [2-[(3R,5S,8S,9S,10S,13S,14S,17S)-3-hydroxy-10,13-dimethyl-11-oxo-1,2,3,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate. LogP 3.2 Topological Polar Surface Area 80.7 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 5 Rotatable Bonds 4 Exact Mass 390.24063 Heavy Atoms 28 Complexity 686.0 InChI Key: QRJOQYLXZPQQMX-FWROMSNXSA-N. SMILES: CC(=O)OCC(=O)C1CCC2C1(CC(=O)C3C2CCC4C3(CCC(C4)O)C)C.

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