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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-isocyanato-4'-methyldiphenylmethane
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Accession:CHEBI:59135 term browser browse the term
Definition:An isocyanate that is diphenylmethane with a isocyanato substituent at the 4-position of one phenyl ring and a methyl group at the 4-position of the other.
Synonyms:exact_synonym: 1-isocyanato-4-(4-methylbenzyl)benzene
 related_synonym: Formula=C15H13NO;   IMDM;   InChI=1S/C15H13NO/c1-12-2-4-13(5-3-12)10-14-6-8-15(9-7-14)16-11-17/h2-9H,10H2,1H3;   InChIKey=UZOVYGYOLBIAJR-UHFFFAOYSA-N;   SMILES=Cc1ccc(Cc2ccc(cc2)N=C=O)cc1
 xref: PMID:3810654

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Path 1
Term Annotations click to browse term
  CHEBI ontology 0
    chemical entity 0
      atom 0
        nonmetal atom 0
          oxygen atom 0
            oxygen molecular entity 0
              organooxygen compound 0
                isocyanates 0
                  4-isocyanato-4'-methyldiphenylmethane 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    p-block element atom 0
                      carbon group element atom 0
                        carbon atom 0
                          organic molecular entity 0
                            heteroorganic entity 0
                              organochalcogen compound 0
                                organooxygen compound 0
                                  isocyanates 0
                                    4-isocyanato-4'-methyldiphenylmethane 0
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