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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:Phaeosphaone B
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Accession:CHEBI:224173 term browser browse the term
Synonyms:exact_synonym: (3R,6S)-3-[(R)-1H-indol-3-yl(methylsulanyl)methyl]-3-methoxy-1-methyl-6-methylsulanyl-6-propan-2-ylpiperazine-2,5-dione
 related_synonym: Formula=C20H27N3O3S2;   InChI=1S/C20H27N3O3S2/c1-12(2)20(28-6)17(24)22-19(26-4,18(25)23(20)3)16(27-5)14-11-21-15-10-8-7-9-13(14)15/h7-12,16,21H,1-6H3,(H,22,24)/t16-,19+,20+/m1/s1;   InChIKey=MMJIEYVVWHZRDB-UXPWSPDFSA-N;   SMILES=S([C@@]1(N(C(=O)[C@@](OC)([C@H](SC)C=2C3=C(C=CC=C3)NC2)NC1=O)C)C(C)C)C


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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 26504
    chemical entity 26484
      atom 26480
        nonmetal atom 25741
          nitrogen atom 22701
            nitrogen molecular entity 22701
              organonitrogen compound 22117
                Phaeosphaone B 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 26504
    subatomic particle 26480
      composite particle 26480
        hadron 26480
          baryon 26480
            nucleon 26480
              atomic nucleus 26480
                atom 26480
                  main group element atom 26217
                    main group molecular entity 26217
                      s-block molecular entity 25456
                        hydrogen molecular entity 24862
                          hydrides 23079
                            inorganic hydride 20549
                              pnictogen hydride 20491
                                nitrogen hydride 20275
                                  azane 20004
                                    ammonia 20003
                                      organic amino compound 20003
                                        amino acid 17301
                                          alpha-amino acid 14773
                                            Phaeosphaone B 0
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