C6146

2-Butenoyl coenzyme A lithium salt

≥90% (HPLC)

• Synonym(s): 2-Butenoyl CoA lithium salt, Crotonoyl Co A lithium salt, Crotonoyl coenzyme A lithium salt
• Empirical Formula (Hill Notation): C₂₅H₄₀N₇O₁₇P₃S
• CAS Number: 102680-35-3
• Molecular Weight: 835.61
• NACRES: NA.51
• PubChem Substance ID: 24892840
• UNSPSC Code: 41106305
• MDL number: MFCD00167413
• Form: powder
• Assay: ≥90% (HPLC)

Properties

• assay: ≥90% (HPLC)
• form: powder
• storage temp.: −20°C
• SMILES string: [Li].C\C=C\C(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(O)(=O)OP(O)(=O)OCC1OC(C(O)C1OP(O)(O)=O)n2cnc3c(N)ncnc23
• InChI: 1S/C25H40N7O17P3S.Li.H/c1-4-5-16(34)53-9-8-27-15(33)6-7-28-23(37)20(36)25(2,3)11-46-52(43,44)49-51(41,42)45-10-14-19(48-50(38,39)40)18(35)24(47-14)32-13-31-17-21(26)29-12-30-22(17)32;;/h4-5,12-14,18-20,24,35-36H,6-11H2,1-3H3,(H,27,33)(H,28,37)(H,41,42)(H,43,44)(H2,26,29,30)(H2,38,39,40);;/b5-4+;;
• InChI key: OXXVXWRNRODUOD-SFKRKKMESA-N

Description

Application

Crotonoyl coenzyme A (2-Butenoyl coenzyme A) may be used as a substrate of enzymes such as Plasmodium falciparum enoyl-ACP reductase and other enoyl-CoA reductases. Crotonoyl –CoA may be used as a substrate analogue for kinetic studies on β-hydroxyacyl-acyl carrier protein (ACP) dehydratase (FabZ).

Safety Information

• Storage Class: 11 - Combustible Solids
• wgk: WGK 3
• flash_point_f: Not applicable
• flash_point_c: Not applicable
• ppe: Eyeshields, Gloves, type N95 (US)