Lavendamycin
[CAS# 81645-09-2]

Identification

• Name: Lavendamycin
• Synonyms: 1-(7-Amino-5,8-Dioxo-2-Quinolyl)-4-Methyl-9H-Pyrido[5,4-B]Indole-3-Carboxylic Acid; 1-(7-Amino-5,8-Diketo-2-Quinolyl)-4-Methyl-9H-$B-Carboline-3-Carboxylic Acid; 1-(7-Amino-5,8-Dioxo-Quinolin-2-Yl)-4-Methyl-9H-Pyrido[5,4-B]Indole-3-Carboxylic Acid
• Molecular Formula: C₂₂H₁₄N₄O₄
• Molecular Weight: 398.38
• CAS Registry Number: 81645-09-2
• SMILES: C1=CC(=NC2=C1C(C=C(C2=O)N)=O)C3=C5C(=C(C)C(=N3)C(=O)O)C4=CC=CC=C4[NH]5
• InChI: 1S/C22H14N4O4/c1-9-16-10-4-2-3-5-13(10)24-20(16)19(26-17(9)22(29)30)14-7-6-11-15(27)8-12(23)21(28)18(11)25-14/h2-8,24H,23H2,1H3,(H,29,30)
• InChIKey: IGQJRDIREIWBQP-UHFFFAOYSA-N

Properties

• Density: 1.561g/cm³ (Cal.)
• Boiling point: 789.952°C at 760 mmHg (Cal.)
• Flash point: 431.547°C (Cal.)