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CHEBI ONTOLOGY - ANNOTATIONS

The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at http://www.ebi.ac.uk/chebi/. The data is made available under the Creative Commons License (CC BY 3.0, http://creativecommons.org/licenses/by/3.0/). For more information see: Degtyarenko et al. (2008) ChEBI: a database and ontology for chemical entities of biological interest. Nucleic Acids Res. 36, D344–D350.

Term:LSM-6455
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Accession:CHEBI:95175 term browser browse the term
Definition:A peptide ergot alkaloid that has formula C32H41N5O5.
Synonyms:related_synonym: Formula=C32H41N5O5;   InChI=1S/C32H41N5O5/c1-17(2)12-25-29(39)36-11-7-10-26(36)32(41)37(25)30(40)31(42-32,18(3)4)34-28(38)20-13-22-21-8-6-9-23-27(21)19(15-33-23)14-24(22)35(5)16-20/h6,8-9,13,15,17-18,20,24-26,33,41H,7,10-12,14,16H2,1-5H3,(H,34,38)/t20-,24?,25+,26?,31-,32+/m1/s1;   InChIKey=YDOTUXAWKBPQJW-ISVRSENOSA-N;   SMILES=CC(C)C[C@H]1C(=O)N2CCCC2[C@]3(N1C(=O)[C@](O3)(C(C)C)NC(=O)[C@H]4CN(C5CC6=CNC7=CC=CC(=C67)C5=C4)C)O
 xref: LINCS:LSM-6455


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Path 1
Term Annotations click to browse term
  CHEBI ontology 19853
    role 19804
      biological role 19804
        biochemical role 19339
          metabolite 19319
            alkaloid 5366
              indole alkaloid 1845
                terpenoid indole alkaloid 1467
                  hemiterpenoid indole alkaloid 26
                    ergot alkaloid 26
                      peptide ergot alkaloid 5
                        LSM-6455 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19853
    subatomic particle 19851
      composite particle 19851
        hadron 19851
          baryon 19851
            nucleon 19851
              atomic nucleus 19851
                atom 19851
                  main group element atom 19744
                    p-block element atom 19744
                      p-block molecular entity 19744
                        carbon group molecular entity 19650
                          organic molecular entity 19639
                            organic group 18550
                              cyclic organic group 1845
                                organic heterobicyclic ring 1845
                                  indole skeleton 1845
                                    indole alkaloid 1845
                                      terpenoid indole alkaloid 1467
                                        hemiterpenoid indole alkaloid 26
                                          ergot alkaloid 26
                                            peptide ergot alkaloid 5
                                              LSM-6455 0
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