Carazolol glucuronide
[CAS# 117374-84-2]

Identification

• Name: Carazolol glucuronide
• Synonyms: (2S,3S,4S,5S,6R)-5-(9H-Carbazol-4-Yloxy)-6-Ethoxy-3,4,5-Trihydroxy-6-[(Isopropylamino)Methyl]Tetrahydropyran-2-Carboxylic Acid; (2S,3S,4S,5S,6R)-5-(9H-Carbazol-4-Yloxy)-6-Ethoxy-3,4,5-Trihydroxy-6-[(Isopropylamino)Methyl]-2-Tetrahydropyrancarboxylic Acid; Carazolol Glucuronide
• Molecular Formula: C₂₄H₃₀N₂O₈
• Molecular Weight: 474.51
• CAS Registry Number: 117374-84-2
• SMILES: [C@@]1(OCC)([C@](O)([C@@H](O)[C@H](O)[C@H](O1)C(=O)O)OC2=CC=CC3=C2C4=C([NH]3)C=CC=C4)CNC(C)C
• InChI: 1S/C24H30N2O8/c1-4-32-23(12-25-13(2)3)24(31,21(28)19(27)20(34-23)22(29)30)33-17-11-7-10-16-18(17)14-8-5-6-9-15(14)26-16/h5-11,13,19-21,25-28,31H,4,12H2,1-3H3,(H,29,30)/t19-,20+,21+,23-,24+/m1/s1
• InChIKey: CQHFRRJZOOJMOU-OWDINHDYSA-N

Properties

• Density: 1.442g/cm³ (Cal.)
• Boiling point: 730.581°C at 760 mmHg (Cal.)
• Flash point: 395.641°C (Cal.)