**This is a beta version of MetaNetX/MNXref, MNXref identifiers may not be final**

3'-dephospho-CoA

Properties Image with InChI numbering Occurences in reactions MNX_ID MNXM1104543 #reac in my sandbox 0 in MNXref (generic) 14 in models (compartimentalized) 21 formula C21H33N7O13P2S charge -2 mass 685.546 reference chebi:57328 InChIKey KDTSHFARGAKYJN-IBOSZNHHSA-L InChI InChI=1S/C21H35N7O13P2S/c1-21(2,16(32)19(33)24-4-3-12(29)23-5-6-44)8-39-43(36,37)41-42(34,35)38-7-11-14(30)15(31)20(40-11)28-10-27-13-17(22)25-9-26-18(13)28/h9-11,14-16,20,30-32,44H,3-8H2,1-2H3,(H,23,29)(H,24,33)(H,34,35)(H,36,37)(H2,22,25,26)/p-2/t11-,14-,15-,16+,20-/m1/s1 SMILES CC(C)(COP(=O)([O-])OP(=O)([O-])OC[C@H]1O[C@@H](N2C=NC3=C2N=CN=C3N)[C@H](O)[C@@H]1O)[C@@H](O)C(=O)NCCC(=O)NCCS

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Similar chemical compounds in external resources

Identifier	Description
reactome:R-ALL-196778 reactomeM:R-ALL-196778 CHEBI:57328 chebi:57328	3'-dephospho-CoA 3'-dephospho-CoA(2-) adenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-sulfanylethyl)amino]propyl}amino)butyl] diphosphate}
sabiork.compound:27337 sabiorkM:27337	3'-Dephospho-CoA
metacyc.compound:DEPHOSPHO-COA metacycM:DEPHOSPHO-COA	3'-dephospho-CoA 3-dephospho-CoA dephosphocoenzyme A
CHEBI:15468 chebi:15468	3'-dephospho-CoA Dephospho-CoA Dephosphocoenzyme A adenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-sulfanylethyl)amino]propyl}amino)butyl] dihydrogen diphosphate} dephospho coenzyme A
bigg.metabolite:dpcoa biggM:dpcoa sabiork.compound:1400 sabiorkM:1400	Dephospho-CoA
hmdb:HMDB0001373	Dephospho-CoA 2'-(5''-Triphosphoribosyl)-3'-dephospho-CoA 3'-Dephospho-CoA 3'-Dephospho-coenzyme A 3'-Dephosphocoenzyme A 3'-Desphospho-coenzyme A 3'-O-Dephosphonocoenzyme A 3'-dephospho-coa Dephospho CoA Dephospho-coenzyme A Dephosphocoenzyme A Desphospho-CoA DpCoA [({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy][(3R)-3-hydroxy-2,2-dimethyl-3-({2-[(2-sulfanylethyl)carbamoyl]ethyl}carbamoyl)propoxy]phosphinic acid
seed.compound:cpd00655 seedM:cpd00655	Dephospho-CoA 3'-Dephospho-CoA 3'-dephospho-CoA 3-dephospho-CoA Dephosphocoenzyme A dephospho-CoA dephosphocoenzyme A dpcoa
kegg.compound:C00882 keggC:C00882	Dephospho-CoA 3'-Dephospho-CoA Dephosphocoenzyme A
vmhM:dpcoa vmhM:dpcoa vmhmetabolite:dpcoa vmhmetabolite:dpcoa	Dephospho-CoA [({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy][(3R)-3-hydroxy-2,2-dimethyl-3-({2-[(2-sulfanylethyl)carbamoyl]ethyl}carbamoyl)pr
lipidmaps:LMFA07050315 lipidmapsM:LMFA07050315	Dephospho-CoA [({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy][3-hydroxy-2,2-dimethyl-3-({2-[(2-sulfanylethyl)carbamoyl]ethyl}carbamoyl)propoxy]phosphinic acid
hmdb:HMDB01373 chebi:11793 chebi:14124 chebi:23642 chebi:41614 chebi:4436 biggM:M_dpcoa keggC:M_C00882 seedM:M_cpd00655 vmhM:M_dpcoa	secondary/obsolete/fantasy identifier