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ONTOLOGY REPORT - ANNOTATIONS


Term:(24R,25R)-3alpha,7alpha,12alpha,24-tetrahydroxy-5beta-cholestan-26-oyl-CoA
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Accession:CHEBI:52050 term browser browse the term
Definition:An acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of (24R,25R)-3alpha,7alpha,12alpha,24-tetrahydroxy-5beta-cholestan-26-oic acid.
Synonyms:exact_synonym: 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-({3-oxo-3-[(2-{[(24R,25R)-3alpha,7alpha,12alpha,24-tetrahydroxy-5beta-cholestan-26-oyl]sulfanyl}ethyl)amino]propyl}amino)butyl] dihydrogen diphosphate}
 related_synonym: (24R,25R)-3alpha,7alpha,12alpha,24-Tetrahydroxy-5beta-cholestanoyl-CoA;   Formula=C48H80N7O21P3S;   InChI=1S/C48H80N7O21P3S/c1-24(28-8-9-29-36-30(19-34(59)48(28,29)6)47(5)13-11-27(56)17-26(47)18-32(36)58)7-10-31(57)25(2)45(64)80-16-15-50-35(60)12-14-51-43(63)40(62)46(3,4)21-73-79(70,71)76-78(68,69)72-20-33-39(75-77(65,66)67)38(61)44(74-33)55-23-54-37-41(49)52-22-53-42(37)55/h22-34,36,38-40,44,56-59,61-62H,7-21H2,1-6H3,(H,50,60)(H,51,63)(H,68,69)(H,70,71)(H2,49,52,53)(H2,65,66,67)/t24-,25-,26+,27-,28-,29+,30+,31-,32-,33-,34+,36+,38-,39-,40+,44-,47+,48-/m1/s1;   InChIKey=PXHZOQNODUPJKC-MTLGCJAASA-N;   SMILES=[H][C@@](C)(CC[C@@H](O)[C@@H](C)C(=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)[C@@]1([H])CC[C@@]2([H])[C@]3([H])[C@H](O)C[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])C[C@H](O)[C@]12C
 xref: KEGG:C15614 "SUBMITTER"
 cyclic_relationship: is_conjugate_acid_of CHEBI:59807


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  CHEBI ontology 19749
    role 19696
      biological role 19694
        biochemical role 19192
          metabolite 19164
            bile acid metabolite 0
              3alpha,7alpha,12alpha,24-tetrahydroxy-5beta-cholestan-26-oyl-CoA 0
                (24R,25R)-3alpha,7alpha,12alpha,24-tetrahydroxy-5beta-cholestan-26-oyl-CoA 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19749
    subatomic particle 19745
      composite particle 19745
        hadron 19745
          baryon 19745
            nucleon 19745
              atomic nucleus 19745
                atom 19745
                  main group element atom 19630
                    p-block element atom 19630
                      chalcogen 19336
                        oxygen atom 19297
                          oxygen molecular entity 19297
                            hydroxides 19050
                              oxoacid 18117
                                pnictogen oxoacid 9845
                                  phosphorus oxoacid 8666
                                    phosphoric acids 7337
                                      phosphoric acid 7337
                                        phosphoric acid derivative 6989
                                          phosphate 6989
                                            organic phosphate 6988
                                              carbohydrate phosphate 1513
                                                phospho sugar 1444
                                                  aldose phosphate 1442
                                                    aldopentose phosphate 1436
                                                      ribose phosphate 1430
                                                        ribonucleotide 1389
                                                          purine ribonucleotide 1362
                                                            adenyl ribonucleotide 1241
                                                              adenosine phosphate 249
                                                                adenosine 5'-phosphate 248
                                                                  ADP 83
                                                                    coenzyme A 28
                                                                      acyl-CoA 28
                                                                        steroidal acyl-CoA 0
                                                                          cholestanoyl-CoA 0
                                                                            3alpha,7alpha,12alpha,24-tetrahydroxy-5beta-cholestan-26-oyl-CoA 0
                                                                              (24R,25R)-3alpha,7alpha,12alpha,24-tetrahydroxy-5beta-cholestan-26-oyl-CoA 0
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RGD is funded by grant HL64541 from the National Heart, Lung, and Blood Institute on behalf of the NIH.