Malonyl Coenzyme A Tetralithium Salt
[CAS# 116928-84-8]

Identification

• Name: Malonyl Coenzyme A Tetralithium Salt
• Synonyms: Malonyl coenzyme A tetralithium salt; 63410_FLUKA
• Molecular Formula: C₂₄H₃₄Li₄N₇O₁₉P₃S
• Molecular Weight: 877.31
• CAS Registry Number: 116928-84-8
• SMILES: [Li+].[Li+].[Li+].[Li+].O=C(O)CC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP([O-])(=O)OP([O-])(=O)OC[C@H]3O[C@@H](n2cnc1c(ncnc12)N)[C@H](O)[C@@H]3OP([O-])([O-])=O
• InChI: 1S/C24H38N7O19P3S.4Li/c1-24(2,19(37)22(38)27-4-3-13(32)26-5-6-54-15(35)7-14(33)34)9-47-53(44,45)50-52(42,43)46-8-12-18(49-51(39,40)41)17(36)23(48-12)31-11-30-16-20(25)28-10-29-21(16)31;;;;/h10-12,17-19,23,36-37H,3-9H2,1-2H3,(H,26,32)(H,27,38)(H,33,34)(H,42,43)(H,44,45)(H2,25,28,29)(H2,39,40,41);;;;/q;4*+1/p-4/t12-,17-,18-,19+,23-;;;;/m1..../s1
• InChIKey: DQLXXYMNINXQSV-QTRRCMKVSA-J

Properties

• Refractive index: (Cal.)