Registration Dossier

General information

Inventory

No inventory information available

Reference substance information

Synonyms
Names:
Identifier:
IUPAC name
(2S)-2-[(5α,7α)-3,6-dimethoxy-17-methyl-18,19-dihydro-4,5-epoxy-6,14-ethenomorphinan-7-yl]-3,3-dimethylbutan-2-ol
Identifier:
common name
(2S)-2-[(5α,7α)-3,6-dimethoxy-17-methyl-18,19-dihydro-4,5-epoxy-6,14-ethenomorphinan-7-yl]-3,3-dimethylbutan-2-ol
Identifier:
common name
7a-(2-hydroxy- 3,3-dimethyl-2-butyl)-6, 14-endo-ethano-6, 7,8,14-tetrahydrothebaine
Identifier:
common name
Buprenorphine hydrochloride stage-3 (BPR-3)
(2S)-2-(4,5α-epoxy-3,6-dimethoxy-17-methyl-6α,14-ethano-14α-morphinan-7α-yl)-3,3-dimethylbutan-2-ol

CAS information

CAS number:
16196-70-6

Molecular and structural information

Molecular formula:
C27H39NO4
Molecular weight:
ca. 441.61
SMILES notation:
CC(C)(C)C(C)(O)[C@H]6C[C@]43CC[C@]6(OC)[C@@H]1Oc5c2c(C[C@H]4N(C)CC[C@@]123)ccc5OC
InChl:
InChI=1S/C27H39NO4/c1-23(2,3)24(4,29)18-15-25-10-11-27(18,31-7)22-26(25)12-13-28(5)19(25)14-16-8-9-17(30-6)21(32-22)20(16)26/h8-9,18-19,22,29H,10-15H2,1-7H3
Structural formula:
Chemical structure