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Substrate Report for: Malonyl-CoA

General
Type CoA, Aminopurin
Chemical_Nomenclature 3-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethylsulfanyl]-3-oxopropanoic acid
Canonical SMILES CC(C)(COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C2N=CN=C3N)O)OP(=O)(O)O)C(C(=O)NCCC(=O)NCCSC(=O)CC(=O)O)O
InChI InChI=1S/C24H38N7O19P3S/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)/t12-,17-,18-,19+,23-/m1/s1
InChIKey LTYOQGRJFJAKNA-DVVLENMVSA-N
Other name(s) Coenzyme A, S-(hydrogen propanedioate) ; MALONYL COENZYME A ; Malonyl CoA ; LTYOQGRJFJAKNA-DVVLENMVSA-N ; Malonyl-coenzyme a
________________________________________________________________________________________________
MW|853.58
Formula|C24H38N7O19P3S
CAS_number|
PubChem|644066
UniChem|LTYOQGRJFJAKNA-DVVLENMVSA-N
IUPHAR|5219
Wikipedia|Malonyl-CoA

Target
Families | Malonyl-CoA ligand of proteins in family: 5_AlphaBeta_hydrolase, 6_AlphaBeta_hydrolase, ABHD11-Acetyl_transferase
Protein | ecoli-ybff

References:
Search PubMed for references concerning: Malonyl-CoA
    Title: High-resolution structure of ybfF from Escherichia coli K12: a unique substrate-binding crevice generated by domain arrangement.
    Park SY, Lee SH, Lee J, Nishi K, Kim YS, Jung CH, Kim JS
    Ref: Journal of Molecular Biology, 376:1426, 2008 : PubMed

            

    Title: Enzyme genomics: Application of general enzymatic screens to discover new enzymes
    Kuznetsova E, Proudfoot M, Sanders SA, Reinking J, Savchenko A, Arrowsmith CH, Edwards AM, Yakunin AF
    Ref: FEMS Microbiology Reviews, 29:263, 2005 : PubMed