Products 1080533-15-8

CAS 1080533-15-8 appears in our catalog under these names: Mirtazapine N-Glucuronide, Mirtazapine N-Glucuronide (Mixture of Diastereomers) Contains Unknown Inorganics >80%, >95% (HPLC). Offered by: Chemat Brand, TRC. Available pack sizes: on request, 1mg, 2,5mg.

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

(2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-(5-methyl-2,19-diaza-5-azoniatetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),8,10,12,16,18-hexaen-5-yl)oxane-2-carboxylic acid (CAS 1080533-15-8) is a chemical compound with the molecular formula C23H28N3O6+ and a molecular weight of 442.5 g/mol. IUPAC name: (2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-(5-methyl-2,19-diaza-5-azoniatetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),8,10,12,16,18-hexaen-5-yl)oxane-2-carboxylic acid. InChIKey: NJWNTUGVCYWWIK-NAZZMSSBSA-O.

Identity
Molecular formulaC23H28N3O6+
Molecular weight442.5 g/mol
IUPAC name(2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-(5-methyl-2,19-diaza-5-azoniatetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),8,10,12,16,18-hexaen-5-yl)oxane-2-carboxylic acid
InChIKeyNJWNTUGVCYWWIK-NAZZMSSBSA-O
SMILESC[N+]1(CCN2C(C1)C3=CC=CC=C3CC4=C2N=CC=C4)[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)C(=O)O)O)O)O

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