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3-hydroxycyclohexa-1,5-diene-1-carbonyl-CoA(4-)
An acyl-CoA(4-) that is the tetraanion of 3-hydroxycyclohexa-1,5-diene-1-carbonyl-CoA arising from deprotonation of phosphate and diphosphate functions.


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04. Bioactive Capabilities of Specific Chemicals : Oxidoreductases [EC:1] > Acting on the CH-CH group of donors [EC:1.3] > With other acceptors [EC:1.3.99] > 3-hydroxybenzoyl-CoA reductase [EC:1.3.99.n1]
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04. Bioactive Capabilities of Specific Chemicals  
04. Bioactive Capabilities of Specific Chemicals
 Oxidoreductases [EC:1] (1697) 
 Acting on the CH-CH group of donors [EC:1.3] (238) 
 With other acceptors [EC:1.3.99] (67) 
 3-hydroxybenzoyl-CoA reductase [EC:1.3.99.n1] (6) 
 3-hydroxycyclohexa-1,5-diene-1-carbonyl-CoA(4-) [CHEBI:58801] (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-hydroxycyclohexa-1,5-diene-1-carbonyl-CoA(4-) [CHEBI:58801] (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-hydroxycyclohexa-1,5-diene-1-carbonyl-CoA(4-) [CHEBI:58801] (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-hydroxycyclohexa-1,5-diene-1-carbonyl-CoA(4-) [CHEBI:58801] (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-hydroxycyclohexa-1,5-diene-1-carbonyl-CoA(4-) [CHEBI:58801] (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-hydroxycyclohexa-1,5-diene-1-carbonyl-CoA(4-) [CHEBI:58801] (1)
ChEBI Compound Accession Identifier  [CHEBI:58801]
ChEBI Compound Description  An acyl-CoA(4-) that is the tetraanion of 3-hydroxycyclohexa-1,5-diene-1-carbonyl-CoA arising from deprotonation of phosphate and diphosphate functions.
ChEBI Compound Identification Number  58801
ChEBI InChI Value  InChI=1S/C28H42N7O18P3S/c1-28(2,22(39)25(40)31-7-6-18(37)30-8-9-57-27(41)15-4-3-5-16(36)10-15)12-50-56(47,48)53-55(45,46)49-11-17-21(52-54(42,43)44)20(38)26(51-17)35-14-34-19-23(29)32-13-33-24(19)35/h3-4,10,13-14,16-17,20-22,26,36,38-39H,5-9,11-12H2,1-2H3,(H,30,37)(H,31,40)(H,45,46)(H,47,48)(H2,29,32,33)(H2,42,43,44)/p-4/t16?,17-,20-,21-,22+,26-/m1/s1
ChEBI InChIKey Value  QDXKTBIXZUTNGC-CRVKRRNDSA-J
ChEBI Compound Name  3-hydroxycyclohexa-1,5-diene-1-carbonyl-CoA(4-)
ChEBI SMILES Value  CC(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)[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)C1=CC(O)CC=C1
ChEBI Substance ID  96079649
ChEBI URL  ChEBI:58801
ChemSpider ID  26331369
Ontomatica Chemical Accession Key (OnChAKey)  QDXKTBIXZUTNGC_CRVKRRNDSA_J_000_000000
PubChem Compound ID  46224558