Chaksine
[CAS# 486-53-3]

Identification

• Name: Chaksine
• Synonyms: (3R,7R,11R,15R)-3,11-Bis[(4R)-2-Amino-4,5-Dihydro-3H-Imidazol-4-Yl]-7,15-Dimethyl-1,9-Dioxacyclohexadecane-2,10-Quinone; C09940; Chaksine
• Molecular Formula: C₂₂H₃₈N₆O₄
• Molecular Weight: 450.58
• CAS Registry Number: 486-53-3
• SMILES: [C@@H]1(NC(=NC1)N)[C@@H]3C(OC[C@@H](CCC[C@H]([C@H]2NC(=NC2)N)C(OC[C@@H](CCC3)C)=O)C)=O
• InChI: 1S/C22H38N6O4/c1-13-5-3-7-15(17-9-25-21(23)27-17)20(30)32-12-14(2)6-4-8-16(19(29)31-11-13)18-10-26-22(24)28-18/h13-18H,3-12H2,1-2H3,(H3,23,25,27)(H3,24,26,28)/t13-,14-,15-,16-,17+,18+/m1/s1
• InChIKey: CGGAHJGHSHWGLE-WJQMWINMSA-N

Properties

• Density: 1.412g/cm³ (Cal.)
• Boiling point: 702.953°C at 760 mmHg (Cal.)
• Flash point: 378.933°C (Cal.)