CAS: 2140-48-9 - Butyryl CoA

Formula: C₂₅H₄₂N₇O₁₇P₃S

InChI: InChI=1S/C25H42N7O17P3S/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/h12-14,18-20,24,35-36H,4-11H2,1-3H3,(H,27,33)(H,28,37)(H,41,42)(H,43,44)(H2,26,29,30)(H2,38,39,40)/t14-,18-,19-,20+,24-/m1/s1

InChI key: InChIKey=CRFNGMNYKDXRTN-CITAKDKDSA-N

SMILES: O=C(SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(N2C=NC=3C(=NC=NC32)N)C(O)C1OP(=O)(O)O)CCC

Synonyms:

• Butyryl coenzyme A
• Coenzyme A, S-butanoate
• Butyryl CoA
• Butanoyl coenzyme A
• Coenzyme A, S-butyrate

Butyryl Coenzyme A

CAS: 2140-48-9

• Formula: C₂₅H₄₂N₇O₁₇P₃S
• Molecular weight: 837.62