2CP

2-CARBOXYPROPYL-COENZYME A

Find entries where: 2CP

is present as a standalone ligand in 2 entries

Find related ligands:

Chemical Component Summary
Name	2-CARBOXYPROPYL-COENZYME A
Identifiers	(2R)-3-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]oxy-2-hydroxy-3,3-dimethyl-butanoyl]amino]propanoylamino]ethylsulfanyl]-2-methyl-propanoic acid
Formula	C₂₅ H₄₂ N₇ O₁₈ P₃ S
Molecular Weight	853.623
Type	NON-POLYMER
Isomeric SMILES	C[C@@H](CSCCNC(=O)CCNC(=O)[C@@H](C(C)(C)CO[P@@](=O)(O)O[P@@](=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)n2cnc3c2ncnc3N)O)OP(=O)(O)O)O)C(=O)O
InChI	InChI=1S/C25H42N7O18P3S/c1-13(24(37)38)9-54-7-6-27-15(33)4-5-28-22(36)19(35)25(2,3)10-47-53(44,45)50-52(42,43)46-8-14-18(49-51(39,40)41)17(34)23(48-14)32-12-31-16-20(26)29-11-30-21(16)32/h11-14,17-19,23,34-35H,4-10H2,1-3H3,(H,27,33)(H,28,36)(H,37,38)(H,42,43)(H,44,45)(H2,26,29,30)(H2,39,40,41)/t13-,14+,17+,18+,19-,23+/m0/s1
InChIKey	YLEVKEKTOJAHCY-UQCJFRAESA-N

Chemical Details
Formal Charge	0
Atom Count	96
Chiral Atom Count	8
Bond Count	98
Aromatic Bond Count	10

Drug Info: DrugBank

DrugBank ID	DB03117 ?
Name	2-carboxypropyl-coenzyme A
Groups	experimental
Synonyms	2-carboxypropyl-coenzyme A

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Methylmalonyl-CoA decarboxylase	MSYQYVNVVTINKVAVIEFNYGRKLNALSKVFIDDLMQALSDLNRPEIRC...	unknown

Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682