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3,8-dioxooct-5-enoyl-CoA(4-)
"An acyl-CoA(4-) oxoanion arising from deprotonation of the phosphate and diphosphate OH groups of 3,8-dioxooct-5-enoyl-CoA; major species at pH 7.3."

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04. Bioactive Capabilities of Specific Chemicals : Hydrolases [EC:3] > Acting on ether bonds [EC:3.3]
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08. Chemical Category: main group molecular entity [CHEBI:33579] > p-block molecular entity [CHEBI:33675] > pnictogen molecular entity [CHEBI:33302] > phosphorus molecular entity [CHEBI:26082] > phosphorus oxoacids and derivatives [CHEBI:36360]
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04. Bioactive Capabilities of Specific Chemicals  
04. Bioactive Capabilities of Specific Chemicals
 Oxidoreductases [EC:1] (1697) 
 Acting on CH or CH2 groups [EC:1.17] (49) 
 With NAD or NADP as acceptor [EC:1.17.1] (21) 
 3-oxo-5,6-dehydrosuberyl-CoA semialdehyde dehydrogenase [EC:1.17.1.7] (6) 
 3,8-dioxooct-5-enoyl-CoA(4-) [CHEBI:63257] (1)
 Hydrolases [EC:3] (824) 
 Acting on ether bonds [EC:3.3] (27) 
 Ether hydrolases [EC:3.3.2] (20) 
 Oxepin-CoA hydrolase [EC:3.3.2.12] (3) 
 3,8-dioxooct-5-enoyl-CoA(4-) [CHEBI:63257] (1)
08. Chemical Category 
08. Chemical Category
 ion [CHEBI:24870] (4391) 
 anion [CHEBI:22563] (3454) 
 organic anion [CHEBI:25696] (3155) 
 organophosphate oxoanion [CHEBI:58945] (1108) 
 acyl-CoA oxoanion [CHEBI:58946] (231) 
 acyl-CoA(4-) [CHEBI:58342] (181) 
 3,8-dioxooct-5-enoyl-CoA(4-) [CHEBI:63257] (1)
 organic ion [CHEBI:25699] (3577) 
 organic anion [CHEBI:25696] (3155) 
 organophosphate oxoanion [CHEBI:58945] (1108) 
 acyl-CoA oxoanion [CHEBI:58946] (231) 
 acyl-CoA(4-) [CHEBI:58342] (181) 
 3,8-dioxooct-5-enoyl-CoA(4-) [CHEBI:63257] (1)
 main group molecular entity [CHEBI:33579] (25650) 
 p-block molecular entity [CHEBI:33675] (25343) 
 pnictogen molecular entity [CHEBI:33302] (10027) 
 phosphorus molecular entity [CHEBI:26082] (2769) 
 phosphorus oxoacids and derivatives [CHEBI:36360] (2691) 
 phosphorus oxoacid derivative [CHEBI:36359] (2628) 
 phosphoric acid derivative [CHEBI:26079] (2611) 
 organophosphate oxoanion [CHEBI:58945] (1108) 
 acyl-CoA oxoanion [CHEBI:58946] (231) 
 acyl-CoA(4-) [CHEBI:58342] (181) 
 3,8-dioxooct-5-enoyl-CoA(4-) [CHEBI:63257] (1)
 carbon group molecular entity [CHEBI:33582] (23847) 
 organic molecular entity [CHEBI:50860] (23769) 
 organic ion [CHEBI:25699] (3577) 
 organic anion [CHEBI:25696] (3155) 
 organophosphate oxoanion [CHEBI:58945] (1108) 
 acyl-CoA oxoanion [CHEBI:58946] (231) 
 acyl-CoA(4-) [CHEBI:58342] (181) 
 3,8-dioxooct-5-enoyl-CoA(4-) [CHEBI:63257] (1)
 polyatomic entity [CHEBI:36357] (18777) 
 heteroatomic molecular entity [CHEBI:37577] (13672) 
 oxoacid derivative [CHEBI:33241] (3254) 
 phosphorus oxoacid derivative [CHEBI:36359] (2628) 
 phosphoric acid derivative [CHEBI:26079] (2611) 
 organophosphate oxoanion [CHEBI:58945] (1108) 
 acyl-CoA oxoanion [CHEBI:58946] (231) 
 acyl-CoA(4-) [CHEBI:58342] (181) 
 3,8-dioxooct-5-enoyl-CoA(4-) [CHEBI:63257] (1)
ChEBI Compound Accession Identifier:   [CHEBI:63257]
ChEBI Compound Description:   "An acyl-CoA(4-) oxoanion arising from deprotonation of the phosphate and diphosphate OH groups of 3,8-dioxooct-5-enoyl-CoA; major species at pH 7.3."
ChEBI Compound Identification Number:   63257
ChEBI InChI Value:   InChI=1S/C29H44N7O19P3S/c1-29(2,24(42)27(43)32-8-7-19(39)31-9-11-59-20(40)12-17(38)6-4-3-5-10-37)14-52-58(49,50)55-57(47,48)51-13-18-23(54-56(44,45)46)22(41)28(53-18)36-16-35-21-25(30)33-15-34-26(21)36/h3-4,10,15-16,18,22-24,28,41-42H,5-9,11-14H2,1-2H3,(H,31,39)(H,32,43)(H,47,48)(H,49,50)(H2,30,33,34)(H2,44,45,46)/p-4/t18-,22-,23-,24+,28-/m1/s1
ChEBI InChIKey Value:   XYGQIZWAZKPGNV-CECATXLMSA-J
ChEBI Compound Name:   3,8-dioxooct-5-enoyl-CoA(4-)
ChEBI SMILES Value:   [H]C(=O)CC([H])=C([H])CC(=O)CC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP([O-])(=O)OP([O-])(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP([O-])([O-])=O)n1cnc2c(N)ncnc12
ChEBI Substance ID:   135610439
ChEBI URL:   ChEBI:63257
ChemSpider ID:   NS
Ontomatica Chemical Accession Key (OnChAKey):   XYGQIZWAZKPGNV_CECATXLMSA_J_000_000000
PubChem Compound ID:   56927762