2-Hydroxy Imipramine Beta-D-Glucuronide

cas: 54190-76-0 — see every product listed under this CAS number, including other names

2-Hydroxy Imipramine Beta-D-Glucuronide (CAS 54190-76-0) is a chemical reagent available from Chemat. Available pack sizes: 1mg, 2mg, 5mg. Offered by: TRC.

brandTRC
catalog numberTRC-H943410-1MG
cas54190-76-0
size1mg
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Structural formula: {0} (CAS {1})

(3R,6R)-6-[[11-[3-(dimethylamino)propyl]-5,6-dihydrobenzo[b][1]benzazepin-3-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid (CAS 54190-76-0) is a chemical compound with the molecular formula C25H32N2O7 and a molecular weight of 472.5 g/mol. IUPAC name: (3R,6R)-6-[[11-[3-(dimethylamino)propyl]-5,6-dihydrobenzo[b][1]benzazepin-3-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid. InChIKey: CBEJFHYWZSCYSD-SJMBRSBPSA-N.

Identity
Molecular formulaC25H32N2O7
Molecular weight472.5 g/mol
IUPAC name(3R,6R)-6-[[11-[3-(dimethylamino)propyl]-5,6-dihydrobenzo[b][1]benzazepin-3-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
InChIKeyCBEJFHYWZSCYSD-SJMBRSBPSA-N
SMILESCN(C)CCCN1C2=C(CCC3=CC=CC=C31)C=C(C=C2)O[C@@H]4C(C([C@H](C(O4)C(=O)O)O)O)O

Computed by PubChem (NCBI)

Synonyms: 2-Hydroxy Imipramine beta-D-Glucuronide, 2-Hydroxyimipramine b-D-glucuronide
Isomers (same molecular formula)
6-[[(1R,15R,17S,18S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid C25H32N2O7
pentan-3-yl (2R)-3-(3,4-dimethoxyphenyl)-2-methyl-3-oxo-2-(2-phenylmethoxycarbonylhydrazinyl)propanoate C25H32N2O7

Also listed as

2-Hydroxyimipramine b-D-glucuronide Biosynth CAS 54190-76-0