Basic information
- Standard SMILES
COc1ccc2c3c1OC1C(=O)CCC4(O)C(C2)N(C)CCC314- InChIKey
BRUQQQPBMZOVGD-UHFFFAOYSA-N- Molecular formula
- C18H21NO4
- Average molar mass
- 315.4 g/mol
- Monoisotopic mass
- 315.14705815
Overview
See also: Oxycodone (annotation moved to); Percocet (annotation moved to); Oxycodone Hydrochloride (annotation moved to) ... View More ...
Names & identifiers
- Preferred name
- 4a-Hydroxy-9-methoxy-3-methyl-2,3,4,4a,5,6-hexahydro-1H-4,12-methano(1)benzofuro(3,2-e)isoquinolin-7(7aH)-one
- IUPAC
- 4a-hydroxy-9-methoxy-3-methyl-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-one
Names & synonyms
DTXSID40859094850-50-04a-Hydroxy-9-methoxy-3-methyl-2,3,4,4a,5,6-hexahydro-1H-4,12-methano(1)benzofuro(3,2-e)isoquinolin-7(7aH)-one4a-Hydroxy-9-methoxy-3-methyl-2,3,4,4a,5,6-hexahydro-1H-4,12-methano[1]benzofuro[3,2-e]isoquinolin-7(7aH)-oneRefChem:1071740DTXCID40204323OxiconeMorphinan-6-one, 4,5.alpha.-epoxy-14-hydroxy-3-methoxy-17-methyl-Tekodin (free base)4a-hydroxy-9-methoxy-3-methyl-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-oneNSC 19043Morphinan-6-one, 4,5-epoxy-14-hydroxy-3-methoxy-17-methyl-, (5.alpha.)-
Show more names
Eucodal (Salt/Mix)Tecodin (Salt/Mix)Dinarkon (Salt/Mix)col-0034,5.alpha.-Epoxy-14-hydroxy-3-methoxy-17-methylmorphinan-6-oneSCHEMBL10064505BRUQQQPBMZOVGD-UHFFFAOYSA-NCGA47791
Database identifiers
- CAS
850-50-0- PubChem CID
- 4635
- DTXSID
DTXSID40859094- Nikkaji
- J23.936D
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 59 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 553
Experimental & physicochemical properties
DrugsPharmaceuticals
Related reactions
3 records
Linked notes
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