Registration Dossier

General information

Inventory

EC number:
245-549-9
EC name:
(5α,6α)-17-(cyclobutylmethyl)-4,5-epoxymorphinan-3,6,14-triol hydrochloride
CAS number:
23277-43-2

No inventory information available

Reference substance information

IUPAC name:
(1S,5R,13R,14S,17S)-4-(cyclobutylmethyl)-12-oxa-4-azapentacyclo[9.6.1.0¹,¹³.0⁵,¹⁷.0⁷,¹⁸]octadeca-7(18),8,10-triene-10,14,17-triol hydrochloride
Synonyms
Names:
17-(cyclobutylmethyl)-4,5-epoxymorphinan-3,6,14-triol hydrochloride

CAS information

CAS number:
23277-43-2

Molecular and structural information

Molecular formula:
C21H27NO4.ClH
Molecular weight:
393.904
SMILES notation:
Cl.O[C@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5O[C@@H]1[C@]2(CCN3CC6CCC6)c45
InChl:
InChI=1/C21H27NO4.ClH/c23-14-5-4-13-10-16-21(25)7-6-15(24)19-20(21,17(13)18(14)26-19)8-9-22(16)11-12-2-1-3-12;/h4-5,12,15-16,19,23-25H,1-3,6-11H2;1H
Structural formula:
Chemical structure