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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:4-amino-2-[amino-(methylthio)methylidene]-3-isocyano-4-(methylthio)-3-butenenitrile
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Accession:CHEBI:92839 term browser browse the term
Definition:An acetal that has formula C8H10N4S2.
Synonyms:related_synonym: Formula=C8H10N4S2;   InChI=1S/C8H10N4S2/c1-12-6(8(11)14-3)5(4-9)7(10)13-2/h10-11H2,2-3H3;   InChIKey=QRTOSWGHCGATQF-UHFFFAOYSA-N;   SMILES=CSC(=C(C#N)C(=C(N)SC)[N+]#[C-])N
 xref: LINCS:LSM-3065


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Path 1
Term Annotations click to browse term
  CHEBI ontology 22001
    chemical entity 21998
      atom 21991
        nonmetal atom 21889
          oxygen atom 21200
            oxygen molecular entity 21200
              organooxygen compound 20606
                acetal 10648
                  4-amino-2-[amino-(methylthio)methylidene]-3-isocyano-4-(methylthio)-3-butenenitrile 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 22001
    subatomic particle 21991
      composite particle 21991
        hadron 21991
          baryon 21991
            nucleon 21991
              atomic nucleus 21991
                atom 21991
                  main group element atom 21920
                    p-block element atom 21920
                      carbon group element atom 21736
                        carbon atom 21654
                          organic molecular entity 21654
                            heteroorganic entity 21303
                              organochalcogen compound 20739
                                organooxygen compound 20606
                                  acetal 10648
                                    4-amino-2-[amino-(methylthio)methylidene]-3-isocyano-4-(methylthio)-3-butenenitrile 0
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