Dehydroemetine
[CAS# 4914-30-1]

Identification

• Classification: API >> Antiparasitic drug >> Anti-amebiasis and anti-trichomoniasis drugs
• Name: Dehydroemetine
• Synonyms: Nsc 131546; Ro 1-9334; Aids-003623
• Molecular Formula: C₂₉H₃₈N₂O₄
• Molecular Weight: 478.63
• CAS Registry Number: 4914-30-1
• EINECS: 225-542-7
• SMILES: [C@H]23C1=CC(=C(C=C1CCN2CC(=C(C3)C[C@@H]5C4=C(C=C(C(=C4)OC)OC)CCN5)CC)OC)OC
• InChI: 1S/C29H38N2O4/c1-6-18-17-31-10-8-20-14-27(33-3)29(35-5)16-23(20)25(31)12-21(18)11-24-22-15-28(34-4)26(32-2)13-19(22)7-9-30-24/h13-16,24-25,30H,6-12,17H2,1-5H3/t24-,25+/m1/s1
• InChIKey: XXLZPUYGHQWHRN-RPBOFIJWSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 604.7±55.0°C at 760 mmHg (Cal.)
• Flash point: 319.5±31.5°C (Cal.)