5-[3-(Methylamino)propyl]-10,11-dihydro-5H-dibenzo[b,f]azepin-2-yl hexopyranosiduronic acid
[CAS# 25521-31-7]

Identification

• Name: 5-[3-(Methylamino)propyl]-10,11-dihydro-5H-dibenzo[b,f]azepin-2-yl hexopyranosiduronic acid
• Synonyms: 2-HYDROXY DESIPRAMINE Î’-D-GLUCURONIDE
• Molecular Formula: C₂₄H₃₀N₂O₇
• Molecular Weight: 458.50
• CAS Registry Number: 25521-31-7
• SMILES: CNCCCN1c2ccccc2CCc3c1ccc(c3)OC4C(C(C(C(O4)C(=O)O)O)O)O
• InChI: 1S/C24H30N2O7/c1-25-11-4-12-26-17-6-3-2-5-14(17)7-8-15-13-16(9-10-18(15)26)32-24-21(29)19(27)20(28)22(33-24)23(30)31/h2-3,5-6,9-10,13,19-22,24-25,27-29H,4,7-8,11-12H2,1H3,(H,30,31)
• InChIKey: XJHAOJJEVSPMBA-UHFFFAOYSA-N

Properties

• Density: 1.369g/cm³ (Cal.)
• Boiling point: 728.316°C at 760 mmHg (Cal.)
• Flash point: 394.271°C (Cal.)
• Refractive index: 1.633 (Cal.)