(5a,6b)-17-(Cyclopropylmethyl)-4,5-epoxy-6-(methylamino)-morphinan-3,14-diol

cas: 102869-99-8 — see every product listed under this CAS number, including other names

(5a,6b)-17-(Cyclopropylmethyl)-4,5-epoxy-6-(methylamino)-morphinan-3,14-diol (CAS 102869-99-8) is a chemical reagent available from Chemat. Available pack sizes: 25mg. Offered by: TRC.

brandTRC
catalog numberTRC-C988740-25MG
cas102869-99-8
size25mg
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Structural formula: {0} (CAS {1})

(4R,4aS,7S,7aR,12bS)-3-(cyclopropylmethyl)-7-(methylamino)-1,2,4,5,6,7,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinoline-4a,9-diol (CAS 102869-99-8) is a chemical compound with the molecular formula C21H28N2O3 and a molecular weight of 356.5 g/mol. IUPAC name: (4R,4aS,7S,7aR,12bS)-3-(cyclopropylmethyl)-7-(methylamino)-1,2,4,5,6,7,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinoline-4a,9-diol. InChIKey: MDPFGNLTFZJSEZ-LAKPAKELSA-N.

Identity
Molecular formulaC21H28N2O3
Molecular weight356.5 g/mol
IUPAC name(4R,4aS,7S,7aR,12bS)-3-(cyclopropylmethyl)-7-(methylamino)-1,2,4,5,6,7,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinoline-4a,9-diol
InChIKeyMDPFGNLTFZJSEZ-LAKPAKELSA-N
SMILESCN[C@H]1CC[C@]2([C@H]3CC4=C5[C@]2([C@H]1OC5=C(C=C4)O)CCN3CC6CC6)O

Computed by PubChem (NCBI)

Synonyms: 6|A-N-Methylnaltrexamine, (5a,6b)-17-(Cyclopropylmethyl)-4,5-epoxy-6-(methylamino)-morphinan-3,14-diol, 6-Dehydroxy-6-methylamine-6alpha-naltrexol, (5a,6a)-17-(Cyclopropylmethyl)-4,5-epoxy-6-(methylamino)-morphinan-3,14-diol, Des-N-(3-furanyl-2-propenamide) Nalfurafine;, MDPFGNLTFZJSEZ-LAKPAKELSA-N, 17-(Cyclopropylmethyl)-6alpha-(methylamino)-5alpha-4,5-epoxymorphinan-3,14-diol
Related forms of this compound
(4R,4aS,7S,7aR,12bS)-3-(cyclopropylmethyl)-7-(methylamino)-1,2,4,5,6,7,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinoline-4a,9-diol C21H28N2O3
Isomers (same molecular formula)
tert-butyl N-[2-(4-aminophenyl)ethyl]-N-[(2R)-2-hydroxy-2-phenylethyl]carbamate C21H28N2O3
1-benzhydryl-4-methylpiperazine;2-hydroxypropanoic acid C21H28N2O3
methyl (2R)-2-[(2R,3R,12bS)-3-ethyl-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-2-yl]-3-hydroxypropanoate C21H28N2O3
2-[4-[(E)-3-phenylprop-2-enyl]piperazine-1-carbonyl]cyclohexane-1-carboxylic acid C21H28N2O3
(1R)-14-(1-hydroxybut-2-en-2-yl)-13-(hydroxymethyl)-3,16-dimethyl-3,16-diazatetracyclo[10.3.1.02,10.04,9]hexadeca-2(10),4(9),5,7-tetraen-7-ol C21H28N2O3
3-hydroxybutan-2-yl 4,7-dimethyl-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxylate C21H28N2O3
N-cycloheptyl-4-(1-methyl-2-oxoquinolin-4-yl)oxybutanamide C21H28N2O3
(2R,4S)-6-ethyl-2-(2-hydroxyethyl)-2,8-dimethyl-4-(2-methylprop-1-enyl)-3,4-dihydropyrano[3,2-c][1,8]naphthyridin-5-one C21H28N2O3
N-methyl-6-oxo-N-[3-(4-propan-2-ylphenyl)cyclobutyl]-7-oxa-5-azaspiro[3.4]octane-2-carboxamide C21H28N2O3

Also listed as

(5Alpha,6Beta)-17-(Cyclopropylmethyl)-4,5-epoxy-6-(methylamino)-morphinan-3,14-diol TRC CAS 102869-99-8