isobutyryl-CoA

Molecular Formula: C₂₅H₄₂N₇O₁₇P₃S

InChI: InChI=1/C25H42N7O17P3S/c1-13(2)24(37)53-8-7-27-15(33)5-6-28-22(36)19(35)25(3,4)10-46-52(43,44)49-51(41,42)45-9-14-18(48-50(38,39)40)17(34)23(47-14)32-12-31-16-20(26)29-11-30-21(16)32/h11-14,17-19,23,34-35H,5-10H2,1-4H3,(H,27,33)(H,28,36)(H,41,42)(H,43,44)(H2,26,29,30)(H2,38,39,40)/t14-,17-,18-,19+,23-/m1/s1/f/h27-28,38-39,41,43H,26H2

InChIKey: InChIKey=AEWHYWSPVRZHCT-GQJYTBCYDY
SMILES: CC(C)C(=O)SCCNC(=O)CCNC(=O)[[email protected]](O)C(C)(C)COP(O)(=O)OP(O)(=O)OC[[email protected]]1O[[email protected]]([[email protected]](O)[[email protected]@H]1OP(O)(O)=O)n2cnc3c(N)ncnc23

Names:
    CHEBI:15479
    isobutyryl-CoA
    Isobutyryl-CoA
    isobutyryl-CoA
    S-(2-methylpropanoyl)-CoA
    2-Methylpropanoyl-CoA
    2-methylpropanoyl-CoA
    2-Methylpropanoyl-CoA
    2-Methylpropionyl-CoA
    2-methylpropionyl-CoA
    2-Methylpropionyl-CoA
    3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-{[3-({2-[(2-methylpropanoyl)sulfanyl]ethyl
    [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[hydroxy-[hydroxy-[(3R)-3-hydroxy-2,2-dimethyl-3-[2-[2-(2-methylpropanoylsulfanyl)ethylcarbamoyl]ethylcarbamoyl]propoxy]phosphoryl]oxy-phosphoryl]oxymethyl]oxolan-3-yl]oxyphosphonic acid

Registries:
    PubChem CID 3036931
    ChEBI 15479
    Kegg C00630
    PubChem ID 3903
    PubChem ID 8143191