Nalmefene Impurity 2

cas: 176220-84-1 — see every product listed under this CAS number, including other names

Nalmefene Impurity 2 (CAS 176220-84-1) is a chemical reagent available from Chemat. Available pack sizes: 10mg, 25mg, 50mg, 100mg, 200mg. Offered by: Hubei YoungXin.

brandHubei YoungXin
catalog number6742N-10mg
cas176220-84-1
size10mg
availability Do potwierdzenia przez Chemat|To be confirmed by Chemat
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properties

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

(4R,4aS,7aS,12bS)-10-[(4R,4aS,7aS,12bS)-3-(cyclopropylmethyl)-4a,9-dihydroxy-7-methylidene-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-10-yl]-3-(cyclopropylmethyl)-7-methylidene-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-4a,9-diol (CAS 176220-84-1) is a chemical compound with the molecular formula C42H48N2O6 and a molecular weight of 676.8 g/mol. IUPAC name: (4R,4aS,7aS,12bS)-10-[(4R,4aS,7aS,12bS)-3-(cyclopropylmethyl)-4a,9-dihydroxy-7-methylidene-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-10-yl]-3-(cyclopropylmethyl)-7-methylidene-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-4a,9-diol. InChIKey: DEKUTJDLMXTWRE-CVQRZJKKSA-N.

Identity
Molecular formulaC42H48N2O6
Molecular weight676.8 g/mol
IUPAC name(4R,4aS,7aS,12bS)-10-[(4R,4aS,7aS,12bS)-3-(cyclopropylmethyl)-4a,9-dihydroxy-7-methylidene-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-10-yl]-3-(cyclopropylmethyl)-7-methylidene-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-4a,9-diol
InChIKeyDEKUTJDLMXTWRE-CVQRZJKKSA-N
SMILESC=C1CC[C@]2([C@H]3CC4=CC(=C(C5=C4[C@]2([C@H]1O5)CCN3CC6CC6)O)C7=C(C8=C9C(=C7)C[C@@H]1[C@]2([C@]9(CCN1CC1CC1)[C@@H](O8)C(=C)CC2)O)O)O

Computed by PubChem (NCBI)

Synonyms: 2,2'-Bisnalmefene, Nalmefene Impurity A, 2,2'-Bis(6-deoxo-6-methylenenaltrexone), 2,2'-Bisnalmefene (>85%), 2,2'-Bisnalmefene (Nalmefene Impurity) (>85%) (1.0mg/ml in Methanol), Nalmefene Impurity, 2,2'-bis(6-Deox o-6-methylenenaltrexone)
Isomers (same molecular formula)
5-methoxy-6-(5-methoxy-2-octyl-1,3-dioxobenzo[de]isoquinolin-6-yl)-2-octylbenzo[de]isoquinoline-1,3-dione C42H48N2O6

Also listed as

Nalmefene Impurity A Chemat Brand CAS 176220-84-1
2,2'-Bisnalmefene (Nalmefene Impurity) (>85%) (1.0mg/ml in Methanol) TRC CAS 176220-84-1
2,2'-Bisnalmefene (>85%), >95% (HPLC) TRC CAS 176220-84-1
2,2'-Bisnalmefene Biosynth CAS 176220-84-1
Nalmefene Impurity 1 Chemat Brand CAS 176220-84-1(free base)