Methylprednisolone aceponate

[(6S,8S,9S,10R,11S,13S,14S,17R)-17-(2-acetyloxyacetyl)-11-hydroxy-6,10,13-trimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl] propanoate

CAS: 86401-95-8

Molecular Formula	`C27H36O7`
Molecular Weight	472.6 g/mol
LogP	3.8
Topological Polar Surface Area	107.0 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	7
Rotatable Bonds	7
Exact Mass	472.2461
Heavy Atoms	34
Complexity	979.0

Chemical Identifiers

CAS Number	86401-95-8
SMILES	`CCC(=O)OC1(CCC2C1(CC(C3C2CC(C4=CC(=O)C=CC34C)C)O)C)C(=O)COC(=O)C`
InChIKey	`DALKLAYLIPSCQL-YPYQNWSCSA-N`

📖 Product Overview

Methylprednisolone aceponate (CAS: 86401-95-8) is a chemical compound with molecular formula C27H36O7 and molecular weight 472.6 g/mol. Its IUPAC systematic name is [(6S,8S,9S,10R,11S,13S,14S,17R)-17-(2-acetyloxyacetyl)-11-hydroxy-6,10,13-trimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl] propanoate. LogP 3.8 Topological Polar Surface Area 107.0 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 7 Rotatable Bonds 7 Exact Mass 472.2461 Heavy Atoms 34 Complexity 979.0 InChI Key: DALKLAYLIPSCQL-YPYQNWSCSA-N. SMILES: CCC(=O)OC1(CCC2C1(CC(C3C2CC(C4=CC(=O)C=CC34C)C)O)C)C(=O)COC(=O)C.

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