10-Hydroxyamitriptyline-N-glucuronide
[CAS# 130209-87-9]

Identification

• Name: 10-Hydroxyamitriptyline-N-glucuronide
• Synonyms: 10-Hydroxyamitriptyline-N-Glucuronide; 10-Oh-At-N-Gluc; Beta-D-Glucopyranuronic Acid, 1-Deoxy-1-((3-(10,11-Dihydro-10-Hydroxy-5H-Dibenzo(A,D)Cyclohepten-5-Ylidene)Propyl)Dimethylammonio)-, Hydroxide, Inner Salt, (Z)-
• Molecular Formula: C₂₆H₃₁NO₇
• Molecular Weight: 469.53
• CAS Registry Number: 130209-87-9
• SMILES: [C@H]1(O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C([O-])=O)[N+](CC\C=C3/C2=CC=CC=C2C(O)CC4=CC=CC=C34)(C)C
• InChI: 1S/C26H31NO7/c1-27(2,25-23(31)21(29)22(30)24(34-25)26(32)33)13-7-12-17-16-9-4-3-8-15(16)14-20(28)19-11-6-5-10-18(17)19/h3-6,8-12,20-25,28-31H,7,13-14H2,1-2H3/b17-12-/t20?,21-,22-,23+,24-,25+/m0/s1
• InChIKey: ROSNKPATLOVTEX-MMVWVLHHSA-N