Registration Dossier

General information

Inventory

EC number:
200-320-2
EC name:
Morphine
CAS number:
57-27-2

No inventory information available

Reference substance information

IUPAC name:
(1S,5R,13R,14S,17R)-4-methyl-12-oxa-4-azapentacyclo[9.6.1.0^{1,13}.0^{5,17}.0^{7,18}]octadeca-7,9,11(18),15-tetraene-10,14-diol
Synonyms
Names:
(5alpha, 6alpha)-7,8-didehydro-4,5-epoxy-17-methylmorphinan-3,6-diol
Aguettant
DepoDur
Morphinan-3,6-diol, 7,8-didehydro-4,5-epoxy-17-methyl- (5?,6?)-
Morphinan-3,6-diol, 7,8-didehydro-4,5-epoxy-17-methyl- (5alpha,6alpha)-
Identifier:
CAS number
57-27-2
Identifier:
IUPAC name
(4R,4aR,7S,7aR,12bS)-3-Methyl-2,3,4,4a,7,7a-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7,9-diol
Identifier:
IUPAC name
(5α,6α)-17-Methyl-7,8-didehydro-4,5-epoxymorphinan-3,6-diol
Identifier:
other: SMILES notation
CN1CC[C@]23c4c5ccc(c4O[C@H] 2[C@H](C=C[C@H]3[C@H]1C5)O)O
17-methyl-7,8-didehydro-4,5-epoxymorphinan-3,6-diol

CAS information

CAS number:
57-27-2

Molecular and structural information

Molecular formula:
C17H19NO3
Molecular weight:
285.338
SMILES notation:
CN1CC[C@]23[C@H]4Oc5c(O)ccc(C[C@@H]1[C@@H]2C=C[C@@H]4O)c35
InChl:
InChI=1/C17H19NO3/c1-18-7-6-17-10-3-5-13(20)16(17)21-15-12(19)4-2-9(14(15)17)8-11(10)18/h2-5,10-11,13,16,19-20H,6-8H2,1H3
Structural formula:
Chemical structure