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04. Bioactive Capabilities of Specific Chemicals
04. Bioactive Capabilities of Specific Chemicals
3-hydroxycyclohexa-1,5-diene-1-carbonyl-CoA(4-) [CHEBI:58801] (1)
08. Chemical Category
08. Chemical Category
3-hydroxycyclohexa-1,5-diene-1-carbonyl-CoA(4-) [CHEBI:58801] (1)
3-hydroxycyclohexa-1,5-diene-1-carbonyl-CoA(4-) [CHEBI:58801] (1)
3-hydroxycyclohexa-1,5-diene-1-carbonyl-CoA(4-) [CHEBI:58801] (1)
3-hydroxycyclohexa-1,5-diene-1-carbonyl-CoA(4-) [CHEBI:58801] (1)
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