(4R,4aS,7aR,12bS)-4a-hydroxy-9-methoxy-3-methyl-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-one,2-[4-(2-methylpropyl)phenyl]propanoic acid

Modify Date: 2025-08-25 20:04:29

(4R,4aS,7aR,12bS)-4a-hydroxy-9-methoxy-3-methyl-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-one,2-[4-(2-methylpropyl)phenyl]propanoic acid Structure
(4R,4aS,7aR,12bS)-4a-hydroxy-9-methoxy-3-methyl-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-one,2-[4-(2-methylpropyl)phenyl]propanoic acid structure
Common Name (4R,4aS,7aR,12bS)-4a-hydroxy-9-methoxy-3-methyl-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-one,2-[4-(2-methylpropyl)phenyl]propanoic acid
CAS Number 701907-98-4 Molecular Weight 521.64400
Density N/A Boiling Point N/A
Molecular Formula C31H39NO6 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name (4R,4aS,7aR,12bS)-4a-hydroxy-9-methoxy-3-methyl-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-one,2-[4-(2-methylpropyl)phenyl]propanoic acid
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C31H39NO6
Molecular Weight 521.64400
Exact Mass 521.27800
PSA 96.30000
LogP 4.05930
InChIKey BYQMUJKLALSITI-RKXJKUSZSA-N
SMILES CC(C)Cc1ccc(C(C)C(=O)O)cc1.COc1ccc2c3c1OC1C(=O)CCC4(O)C(C2)N(C)CCC314

 Synonyms

Oxycodone hydrochloride and Ibuprofen
Oxycodone/Ibuprofen combination
Ibuprofen/Oxycodone combination
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