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ONTOLOGY REPORT - ANNOTATIONS


Term:cyclosporin A metabolite M18
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Accession:CHEBI:140175 term browser browse the term
Definition:A cyclosporin A derivative that is cyclosporin A metabolite M17 in which the hydroxy group at position 3 of residue 1 [(2S,3R,4R,6E)-3,8-dihydroxy-4-methyl-2-(methylamino)oct-6-enamide] has undergone addition to the double bond at position 6 to afford the corresponding dioxolane ring.
Synonyms:exact_synonym: (3S,6S,9S,12R,15S,18S,21S,24S,30S,33S)-30-ethyl-33-[(2R,3R)-5-(2-hydroxyethyl)-3-methyltetrahydrofuran-2-yl]-6,9,18,24-tetraisobutyl-3,21-diisopropyl-1,4,7,10,12,15,19,25,28-nonamethyl-1,4,7,10,13,16,19,22,25,28,31-undecaazacyclotritriacontane-2,5,8,11,14,17,20,23,26,29,32-undecone
 related_synonym: AM1c;   Formula=C62H111N11O13;   InChI=1S/C62H111N11O13/c1-24-43-58(81)67(17)32-48(75)68(18)44(27-33(2)3)55(78)66-49(37(10)11)61(84)69(19)45(28-34(4)5)54(77)63-40(15)53(76)64-41(16)57(80)70(20)46(29-35(6)7)59(82)71(21)47(30-36(8)9)60(83)72(22)50(38(12)13)62(85)73(23)51(56(79)65-43)52-39(14)31-42(86-52)25-26-74/h33-47,49-52,74H,24-32H2,1-23H3,(H,63,77)(H,64,76)(H,65,79)(H,66,78)/t39-,40+,41-,42?,43+,44+,45+,46+,47+,49+,50+,51+,52-/m1/s1;   InChIKey=OPQZHVFVHOLQNE-JFGKHBSWSA-N;   M18;   SMILES=[C@H]1(N(C([C@@H](N(C([C@@H](N(C)C([C@@H](N(C([C@H](NC([C@@H](NC([C@@H](N(C([C@@H](NC([C@@H](N(C)C(CN(C([C@@H](NC1=O)CC)=O)C)=O)CC(C)C)=O)C(C)C)=O)C)CC(C)C)=O)C)=O)C)=O)C)CC(C)C)=O)CC(C)C)=O)C)C(C)C)=O)C)[C@]2([C@H](C)CC(O2)(CCO)[H])[H];   cyclosporin A metabolite AM1c;   cyclosporin metabolite AM1c;   cyclosporin metabolite M18;   cyclosporine A metabolite AM1c;   cyclosporine A metabolite M18;   cyclosporine metabolite AM1c;   cyclosporine metabolite M18
 xref: PMID:1362930 "Europe PMC";   PMID:17301005 "Europe PMC";   PMID:1834063 "Europe PMC";   PMID:1895678 "Europe PMC";   PMID:1943052 "Europe PMC";   PMID:1971578 "Europe PMC";   PMID:2060135 "Europe PMC";   PMID:22210099 "Europe PMC";   PMID:2297901 "Europe PMC";   PMID:2950629 "Europe PMC";   PMID:2966788 "Europe PMC";   PMID:3311467 "Europe PMC";   PMID:3538573 "Europe PMC";   PMID:7624874 "Europe PMC";   PMID:8400080 "Europe PMC";   PMID:8894806 "Europe PMC";   PMID:8971957 "Europe PMC"


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  CHEBI ontology 23754
    role 23643
      biological role 23606
        biochemical role 22955
          metabolite 22847
            cyclosporin A 8740
              cyclosporin A derivative 0
                cyclosporin A metabolite M18 0
                  cyclosporin A metabolite M1cAL 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 23754
    subatomic particle 23703
      composite particle 23703
        hadron 23703
          baryon 23703
            nucleon 23703
              atomic nucleus 23703
                atom 23703
                  main group element atom 23522
                    p-block element atom 23522
                      carbon group element atom 23232
                        carbon atom 23208
                          organic molecular entity 23208
                            organic group 21897
                              organic divalent group 21869
                                organodiyl group 21869
                                  carbonyl group 21840
                                    carbonyl compound 21840
                                      carboxylic acid 20885
                                        carboacyl group 18982
                                          univalent carboacyl group 18982
                                            carbamoyl group 18370
                                              carboxamide 18370
                                                peptide 9768
                                                  cyclic peptide 9177
                                                    homodetic cyclic peptide 8768
                                                      cyclosporin A 8740
                                                        cyclosporin A derivative 0
                                                          cyclosporin A metabolite M17 0
                                                            cyclosporin A metabolite M18 0
                                                              cyclosporin A metabolite M1cAL 0
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RGD is funded by grant HL64541 from the National Heart, Lung, and Blood Institute on behalf of the NIH.