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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:D-nopaline
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Accession:CHEBI:17249 term browser browse the term
Definition:An amino acid opine resulting from the formal reductive condensation of the amino group of L-arginine with the keto group of 2-oxopentanedioic acid.
Synonyms:exact_synonym: (2R)-2-{[(1S)-4-carbamimidamido-1-carboxybutyl]amino}pentanedioic acid
 related_synonym: (S)-N-(4-((Aminoiminomethyl)amino)-1-carboxybutyl)-D-glutamic acid;   Formula=C11H20N4O6;   InChI=1S/C11H20N4O6/c12-11(13)14-5-1-2-6(9(18)19)15-7(10(20)21)3-4-8(16)17/h6-7,15H,1-5H2,(H,16,17)(H,18,19)(H,20,21)(H4,12,13,14)/t6-,7+/m0/s1;   InChIKey=LMKYZBGVKHTLTN-NKWVEPMBSA-N;   N(2)-(D-1,3-dicarboxypropyl)-L-arginine;   N-[(1S)-4-carbamimidamido-1-carboxybutyl]-D-glutamic acid;   N-[4-[(Aminoiminomethyl)amino]-1-carboxybutyl]-D-glutamic acid(ECL);   N2-(D-1,3-Dicarboxypropyl)-L-arginine;   Nopaline;   SMILES=NC(=N)NCCC[C@H](N[C@H](CCC(O)=O)C(O)=O)C(O)=O
 alt_id: CHEBI:12630;   CHEBI:21809;   CHEBI:4216;   CHEBI:7365;   CHEBI:7620
 xref: CAS:22350-70-5;   KEGG:C01682;   KEGG:C08508;   KNApSAcK:C00001548
 cyclic_relationship: is_conjugate_acid_of CHEBI:58074


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  CHEBI ontology 0
    role 0
      application 0
        refrigerant 0
          ammonia 0
            organic amino compound 0
              secondary amino compound 0
                D-nopaline 0
Path 2
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  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
                            organic group 0
                              organic divalent group 0
                                organodiyl group 0
                                  carbonyl group 0
                                    carbonyl compound 0
                                      carboxylic acid 0
                                        amino acid 0
                                          alpha-amino acid 0
                                            L-alpha-amino acid 0
                                              glutamine family amino acid 0
                                                L-arginine 0
                                                  L-arginine derivative 0
                                                    D-nopaline 0
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