Products 1178907-31-7

CAS 1178907-31-7 appears in our catalog under these names: Naltrexone methylbromide Impurity D, 2,2'-Bis(N-Methyl Naltrexone) Dibromide. Offered by: Chemat Brand, TRC. Available pack sizes: on request, 10mg.

Naltrexone methylbromide Impurity D
Chemat Brand
  • size: on request
  • Variants: 1
View product
2,2'-Bis(N-Methyl Naltrexone) Dibromide
TRC
  • size: 10mg
  • Variants: 1
View product

(3R,4R,4aS,7aR,12bS)-10-[(3R,4R,4aS,7aR,12bR)-3-(cyclopropylmethyl)-4a,9-dihydroxy-3-methyl-7-oxo-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-3-ium-10-yl]-3-(cyclopropylmethyl)-4a,9-dihydroxy-3-methyl-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-3-ium-7-one dibromide (CAS 1178907-31-7) is a chemical compound with the molecular formula C42H50Br2N2O8 and a molecular weight of 870.7 g/mol. IUPAC name: (3R,4R,4aS,7aR,12bS)-10-[(3R,4R,4aS,7aR,12bR)-3-(cyclopropylmethyl)-4a,9-dihydroxy-3-methyl-7-oxo-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-3-ium-10-yl]-3-(cyclopropylmethyl)-4a,9-dihydroxy-3-methyl-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-3-ium-7-one dibromide. InChIKey: XPJNWEWLFZNHHR-MOWZEBMDSA-N.

Identity
Molecular formulaC42H50Br2N2O8
Molecular weight870.7 g/mol
IUPAC name(3R,4R,4aS,7aR,12bS)-10-[(3R,4R,4aS,7aR,12bR)-3-(cyclopropylmethyl)-4a,9-dihydroxy-3-methyl-7-oxo-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-3-ium-10-yl]-3-(cyclopropylmethyl)-4a,9-dihydroxy-3-methyl-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-3-ium-7-one dibromide
InChIKeyXPJNWEWLFZNHHR-MOWZEBMDSA-N
SMILESC[N@@+]1(CC[C@]23[C@@H]4C(=O)CC[C@]2([C@H]1CC5=CC(=C(C(=C35)O4)O)C6=C(C7=C8C(=C6)C[C@@H]9[C@]1([C@@]8(CC[N@+]9(C)CC2CC2)[C@@H](O7)C(=O)CC1)O)O)O)CC1CC1.[Br-].[Br-]

Computed by PubChem (NCBI)

Synonyms: 2,2'-Bis(N-Methyl Naltrexone) Dibromide, Naltrexone Methylbromide Impurity D