BNTX maleate

cas: 864461-31-4 — see every product listed under this CAS number, including other names

BNTX maleate (CAS 864461-31-4) is a chemical reagent available from Chemat. Available pack sizes: 1mg, 5mg, 10mg. Offered by: TargetMol.

brandTargetMol
catalog numberT22613-1mg
cas864461-31-4
size1mg
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Available pack sizes

brand size price
TargetMol 1mg 605.28 Pln
TargetMol 5mg 1807.13 Pln
TargetMol 10mg 3228.10 Pln

properties

purityNo data
delivery timeon request
Structural formula: {0} (CAS {1})

(4R,4aS,6E,7aR,12bS)-6-benzylidene-3-(cyclopropylmethyl)-4a,9-dihydroxy-1,2,4,5,7a,13-hexahydro-4,12-methanobenzofuro[3,2-e]isoquinolin-7-one;(Z)-but-2-enedioic acid (CAS 864461-31-4) is a chemical compound with the molecular formula C31H31NO8 and a molecular weight of 545.6 g/mol. IUPAC name: (4R,4aS,6E,7aR,12bS)-6-benzylidene-3-(cyclopropylmethyl)-4a,9-dihydroxy-1,2,4,5,7a,13-hexahydro-4,12-methanobenzofuro[3,2-e]isoquinolin-7-one;(Z)-but-2-enedioic acid. InChIKey: GKHUUKGUNNYVGB-LQDKARLYSA-N.

Identity
Molecular formulaC31H31NO8
Molecular weight545.6 g/mol
IUPAC name(4R,4aS,6E,7aR,12bS)-6-benzylidene-3-(cyclopropylmethyl)-4a,9-dihydroxy-1,2,4,5,7a,13-hexahydro-4,12-methanobenzofuro[3,2-e]isoquinolin-7-one;(Z)-but-2-enedioic acid
InChIKeyGKHUUKGUNNYVGB-LQDKARLYSA-N
SMILESC1CC1CN2CC[C@]34[C@@H]5C(=O)/C(=C/C6=CC=CC=C6)/C[C@]3([C@H]2CC7=C4C(=C(C=C7)O)O5)O.C(=C\C(=O)O)\C(=O)O

Computed by PubChem (NCBI)

Synonyms: BNTX maleate, 7-Benzylidenenaltrexone maleate, BNTX maleate salt hydrate, BNTX (maleate), orb1704653, Tox21_500588
Isomers (same molecular formula)
2-[(2S,3R,4R,5S,6R)-5-hydroxy-2-(4-methoxyphenoxy)-6-(phenylmethoxymethyl)-4-prop-2-enoxyoxan-3-yl]isoindole-1,3-dione C31H31NO8

Also listed as

BNTX (maleate), 98.2% MedChemExpress CAS 864461-31-4