Lumirubin
[CAS# 83664-21-5]

Identification

• Name: Lumirubin
• Synonyms: Lumirubin; Lumirubin Ix; Lumirubin Xiii
• Molecular Formula: C₃₃H₃₆N₄O₆
• Molecular Weight: 584.67
• CAS Registry Number: 83664-21-5
• SMILES: C(C2=C(NC3=CC1=NC(=O)C(C1=CCC23C)C)CC4=C(C(=C([NH]4)\C=C/5NC(=O)C(=C5C)C=C)C)CCC(O)=O)CC(O)=O
• InChI: 1S/C33H36N4O6/c1-6-19-16(2)24(36-32(19)43)13-23-17(3)20(7-9-29(38)39)25(34-23)14-27-22(8-10-30(40)41)33(5)12-11-21-18(4)31(42)37-26(21)15-28(33)35-27/h6,11,13,15,18,34-35H,1,7-10,12,14H2,2-5H3,(H,36,43)(H,38,39)(H,40,41)/b24-13+
• InChIKey: YNYZRBOEYUCGSF-ZMOGYAJESA-N

Properties

• Density: 1.38g/cm³ (Cal.)