Products 1206487-81-1

CAS 1206487-81-1 appears in our catalog under these names: N–Benzylnaltrindole hydrochloride, N-Benzylnaltrindole (hydrochloride). Offered by: GLPBio, MedChemExpress. Available pack sizes: 10mg, 50mg, Get quote.

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

(1S,2S,13R)-11-benzyl-22-(cyclopropylmethyl)-14-oxa-11,22-diazaheptacyclo[13.9.1.01,13.02,21.04,12.05,10.019,25]pentacosa-4(12),5,7,9,15,17,19(25)-heptaene-2,16-diol;hydrochloride (CAS 1206487-81-1) is a chemical compound with the molecular formula C33H33ClN2O3 and a molecular weight of 541.1 g/mol. IUPAC name: (1S,2S,13R)-11-benzyl-22-(cyclopropylmethyl)-14-oxa-11,22-diazaheptacyclo[13.9.1.01,13.02,21.04,12.05,10.019,25]pentacosa-4(12),5,7,9,15,17,19(25)-heptaene-2,16-diol;hydrochloride. InChIKey: KDEBSUYWJUBPCB-ZHYTUUPESA-N.

Identity
Molecular formulaC33H33ClN2O3
Molecular weight541.1 g/mol
IUPAC name(1S,2S,13R)-11-benzyl-22-(cyclopropylmethyl)-14-oxa-11,22-diazaheptacyclo[13.9.1.01,13.02,21.04,12.05,10.019,25]pentacosa-4(12),5,7,9,15,17,19(25)-heptaene-2,16-diol;hydrochloride
InChIKeyKDEBSUYWJUBPCB-ZHYTUUPESA-N
SMILESC1CC1CN2CC[C@]34[C@@H]5C6=C(C[C@]3(C2CC7=C4C(=C(C=C7)O)O5)O)C8=CC=CC=C8N6CC9=CC=CC=C9.Cl

Computed by PubChem (NCBI)