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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:2-[(1-oxo-3-phenylpropyl)amino]-3-thiophenecarboxylic acid methyl ester
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Accession:CHEBI:113098 term browser browse the term
Definition:A thiophenecarboxylic acid that has formula C15H15NO3S.
Synonyms:related_synonym: Formula=C15H15NO3S;   InChI=1S/C15H15NO3S/c1-19-15(18)12-9-10-20-14(12)16-13(17)8-7-11-5-3-2-4-6-11/h2-6,9-10H,7-8H2,1H3,(H,16,17);   InChIKey=MTQVMVKSXBFESI-UHFFFAOYSA-N;   SMILES=COC(=O)C1=C(SC=C1)NC(=O)CCC2=CC=CC=C2
 xref: LINCS:LSM-24508


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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19785
    role 19732
      chemical role 19248
        donor 18377
          Bronsted acid 18240
            oxoacid 18192
              carbon oxoacid 18071
                carboxylic acid 18060
                  thiophenecarboxylic acid 14
                    2-[(1-oxo-3-phenylpropyl)amino]-3-thiophenecarboxylic acid methyl ester 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19785
    subatomic particle 19782
      composite particle 19782
        hadron 19782
          baryon 19782
            nucleon 19782
              atomic nucleus 19782
                atom 19782
                  main group element atom 19670
                    p-block element atom 19670
                      carbon group element atom 19572
                        carbon atom 19561
                          organic molecular entity 19561
                            organic group 18493
                              organic divalent group 18486
                                organodiyl group 18486
                                  carbonyl group 18389
                                    carbonyl compound 18389
                                      carboxylic acid 18060
                                        thiophenecarboxylic acid 14
                                          2-[(1-oxo-3-phenylpropyl)amino]-3-thiophenecarboxylic acid methyl ester 0
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