Products 547767-36-2

CAS 547767-36-2 is the registry number for 3-O-Benzyl Naltrexone Ethylene Ketal. Offered by: TRC. Available pack sizes: 10mg, 25mg, 50mg.

3-O-Benzyl Naltrexone Ethylene Ketal
TRC
  • size: 10mg, 25mg, 50mg
  • Variants: 3
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Structural formula: {0} (CAS {1})

(4'R,4'aS,7'aR,12'bS)-3'-(cyclopropylmethyl)-9'-phenylmethoxyspiro[1,3-dioxolane-2,7'-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline]-4'a-ol (CAS 547767-36-2) is a chemical compound with the molecular formula C29H33NO5 and a molecular weight of 475.6 g/mol. IUPAC name: (4'R,4'aS,7'aR,12'bS)-3'-(cyclopropylmethyl)-9'-phenylmethoxyspiro[1,3-dioxolane-2,7'-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline]-4'a-ol. InChIKey: TVQSTQLEXHQHAQ-NNTQFHGGSA-N.

Identity
Molecular formulaC29H33NO5
Molecular weight475.6 g/mol
IUPAC name(4'R,4'aS,7'aR,12'bS)-3'-(cyclopropylmethyl)-9'-phenylmethoxyspiro[1,3-dioxolane-2,7'-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline]-4'a-ol
InChIKeyTVQSTQLEXHQHAQ-NNTQFHGGSA-N
SMILESC1CC1CN2CC[C@]34[C@@H]5C6(CC[C@]3([C@H]2CC7=C4C(=C(C=C7)OCC8=CC=CC=C8)O5)O)OCCO6

Computed by PubChem (NCBI)

Synonyms: 3-O-Benzyl Naltrexone Ethylene Ketal
Isomers (same molecular formula)
(2S)-1-[[2,6-dimethoxy-4-[(2-methyl-3-phenylphenyl)methoxy]phenyl]methyl]piperidine-2-carboxylic acid C29H33NO5
9H-fluoren-9-ylmethyl N-[6-(4,4-dimethyl-2,6-dioxocyclohexylidene)-6-hydroxyhexyl]carbamate C29H33NO5