Products 67829-18-9

CAS 67829-18-9 is the registry number for 2-Hydroxy-3-O-methylnaltrexone. Offered by: TRC. Available pack sizes: 100mg.

Structural formula: {0} (CAS {1})

(4R,4aS,7aR,12bS)-3-(cyclopropylmethyl)-4a,10-dihydroxy-9-methoxy-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-one (CAS 67829-18-9) is a chemical compound with the molecular formula C21H25NO5 and a molecular weight of 371.4 g/mol. IUPAC name: (4R,4aS,7aR,12bS)-3-(cyclopropylmethyl)-4a,10-dihydroxy-9-methoxy-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-one. InChIKey: YEOJRVQCDBXMRW-PSOYPTMXSA-N.

Identity
Molecular formulaC21H25NO5
Molecular weight371.4 g/mol
IUPAC name(4R,4aS,7aR,12bS)-3-(cyclopropylmethyl)-4a,10-dihydroxy-9-methoxy-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-one
InChIKeyYEOJRVQCDBXMRW-PSOYPTMXSA-N
SMILESCOC1=C(C=C2C[C@@H]3[C@@]4(CCC(=O)[C@H]5[C@@]4(C2=C1O5)CCN3CC6CC6)O)O

Computed by PubChem (NCBI)