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ONTOLOGY REPORT - ANNOTATIONS


Term:S-nitroso-coenzyme A(4-)
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Accession:CHEBI:145546 term browser browse the term
Definition:A S-nitrosothiol derivative of coenzyme A; major species at pH 7.3.
Synonyms:related_synonym: Formula=C21H31N8O17P3S;   InChI=1S/C21H35N8O17P3S/c1-21(2,16(32)19(33)24-4-3-12(30)23-5-6-50-28-34)8-43-49(40,41)46-48(38,39)42-7-11-15(45-47(35,36)37)14(31)20(44-11)29-10-27-13-17(22)25-9-26-18(13)29/h9-11,14-16,20,31-32H,3-8H2,1-2H3,(H,23,30)(H,24,33)(H,38,39)(H,40,41)(H2,22,25,26)(H2,35,36,37)/p-4/t11-,14-,15-,16+,20-/m1/s1;   InChIKey=CNWRHTNOZSOAKE-IBOSZNHHSA-J;   S-nitroso-CoA;   SMILES=[C@@H]1(N2C3=C(C(=NC=N3)N)N=C2)O[C@H](COP(OP(OCC([C@H](C(NCCC(NCCSN=O)=O)=O)O)(C)C)(=O)[O-])(=O)[O-])[C@H]([C@H]1O)OP([O-])([O-])=O
 xref: PMID:31649033


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Path 1
Term Annotations click to browse term
  CHEBI ontology 21269
    chemical entity 21267
      group 21141
        inorganic group 19846
          nitroso group 5032
            nitroso compound 5032
              nitrosothio compound 84
                S-nitroso-coenzyme A(4-) 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 21269
    subatomic particle 21265
      composite particle 21265
        hadron 21265
          baryon 21265
            nucleon 21265
              atomic nucleus 21265
                atom 21265
                  main group element atom 21134
                    p-block element atom 21134
                      chalcogen 20177
                        oxygen atom 20164
                          oxygen molecular entity 20164
                            hydroxides 19776
                              oxoacid 19110
                                pnictogen oxoacid 10168
                                  phosphorus oxoacid 9040
                                    phosphoric acids 7812
                                      phosphoric acid 7812
                                        phosphoric acid derivative 7473
                                          organophosphate oxoanion 1
                                            coenzyme A(4-) 0
                                              S-nitroso-coenzyme A(4-) 0
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RGD is funded by grant HL64541 from the National Heart, Lung, and Blood Institute on behalf of the NIH.