CHEBI:61623 - fluoroacetyl-CoA(4−)

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ChEBI Name fluoroacetyl-CoA(4−) ChEBI ID CHEBI:61623 ChEBI ASCII Name fluoroacetyl-CoA(4-) Definition An acyl-CoA oxoanion that results from the removal of four protons from the phosphate groups of fluoroacetyl-CoA. Protonated to pH 7.3. Stars This entity has been manually annotated by the ChEBI Team. Submitter Kristian Axelsen Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C23H33FN7O17P3S Net Charge -4 Average Mass 823.53000 Monoisotopic Mass 823.08725 InChI InChI=1S/C23H37FN7O17P3S/c1-23(2,18(35)21(36)27-4-3-13(32)26-5-6-52-14(33)7-24)9-45-51(42,43)48-50(40,41)44-8-12-17(47-49(37,38)39)16(34)22(46-12)31-11-30-15-19(25)28-10-29-20(15)31/h10-12,16-18,22,34-35H,3-9H2,1-2H3,(H,26,32)(H,27,36)(H,40,41)(H,42,43)(H2,25,28,29)(H2,37,38,39)/p-4/t12-,16-,17-,18+,22-/m1/s1 InChIKey MXORLDKQFQCTLP-GRFIIANRSA-J SMILES 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)CF ChEBI Ontology Outgoing fluoroacetyl-CoA(4−) (CHEBI:61623) is a acyl-CoA(4−) (CHEBI:58342) fluoroacetyl-CoA(4−) (CHEBI:61623) is conjugate base of fluoroacetyl-CoA (CHEBI:61646) Incoming fluoroacetyl-CoA (CHEBI:61646) is conjugate acid of fluoroacetyl-CoA(4−) (CHEBI:61623) Synonym Source fluoroacetyl-CoA UniProt Manual Xref Database 3P2R PDB View more database links Citation Type Source 20430898 PubMed citation SUBMITTER Last Modified 11 March 2011