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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:valeric acid
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Accession:CHEBI:17418 term browser browse the term
Definition:A straight-chain saturated fatty acid containing five carbon atoms.
Synonyms:related_synonym: 1-butanecarboxylic acid;   CH3-[CH2]3-COOH;   Formula=C5H10O2;   InChI=1S/C5H10O2/c1-2-3-4-5(6)7/h2-4H2,1H3,(H,6,7);   InChIKey=NQPDZGIKBAWPEJ-UHFFFAOYSA-N;   Pentanoate;   Pentanoic acid;   SMILES=CCCCC(O)=O;   Valerate;   Valerianic acid;   Valeriansaeure;   Valeric acid normal;   n-BuCOOH;   n-Pentanoate;   n-pentanoic acid;   n-valeric acid;   pentoic acid;   propylacetic acid
 alt_id: CHEBI:113448;   CHEBI:27263;   CHEBI:27264;   CHEBI:43606;   CHEBI:44803;   CHEBI:7980
 xref: Beilstein:969454;   CAS:109-52-4;   DrugBank:DB02406;   Gmelin:26714;   HMDB:HMDB0000892;   KEGG:C00803;   KNApSAcK:C00001208;   LIPID_MAPS_instance:LMFA01010005
 xref_mesh: MESH:C038780
 xref: PDBeChem:LEA;   PMID:20507156;   PPDB:3130;   Reaxys:969454;   Wikipedia:Valeric_acid
 cyclic_relationship: is_conjugate_acid_of CHEBI:31011


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    Path 1
    Term Annotations click to browse term
      CHEBI ontology 19876
        role 19851
          biological role 19849
            biochemical role 19543
              metabolite 19529
                eukaryotic metabolite 19342
                  plant metabolite 17926
                    valeric acid 14537
                      (2R,3R)-2,3-dihydroxy-3-methylpentanoic acid 0
                      (2R,3S)-2-hydroxy-3-methylpentanoic acid 0
                      (2S)-2-[(R)-1-carboxyethylamino]pentanoic acid 0
                      (4R)-4-hydroxypentanoic acid + 0
                      (S)-4-amino-5-oxopentanoic acid 0
                      1-octadecanoyl-2-pentanoyl-sn-glycero-3-phosphocholine 0
                      1-palmitoyl-2-valeroyl-sn-glycero-3-phosphocholine 0
                      2,3,4-trihydroxypentanoic acid 0
                      2,5-dioxopentanoic acid 0
                      2-amino-4-oxopentanoic acid + 0
                      2-aminopentanoic acid + 1
                      2-hydroxy-4-methylvalerate + 0
                      2-hydroxy-4-methylvaleric acid + 1
                      2-hydroxypentanoic acid + 0
                      2-methyl-3-ketovaleric acid 0
                      2-phenylethyl pentanoate 0
                      3,5-dihydroxy-3-methylpentanoic acid + 115
                      3-hydroxy-3-methyl-2-oxopentanoic acid + 0
                      3-hydroxypentanoic acid + 0
                      3-methyl-2-oxovaleric acid + 1
                      4,5-dioxopentanoic acid 0
                      4-hydroxy-2-oxopentanoic acid + 0
                      4-methyl-2-oxopentanoic acid 4
                      4-methyl-3-oxopentanoic acid 0
                      5-(2,3-dimethoxy-4-methylphenyl)pentanoic acid 0
                      5-[(1-phenylcyclohexyl)amino]pentanoic acid 0
                      5-[(4-nitrobenzyl)(phosphonomethyl)amino]valeric acid 0
                      5-\{3-[(2,4-diaminopyrimidin-5-yl)methyl]-4-methoxyphenoxy\}pentanoic acid 0
                      5-amino-2-oxopentanoic acid 0
                      5-aminopentanoic acid + 0
                      5-guanidino-2-oxopentanoic acid 0
                      5-guanidino-3-methyl-2-oxopentanoic acid 0
                      5-hydroxypentanoic acid + 0
                      5-phenylpentanoic acid 0
                      O-valeroylcarnitine + 0
                      acetylpyruvic acid + 0
                      ethyl (4R)-4-[((2R,5S)-2-(4-fluorobenzyl)-6-methyl-5-\{[(5-methylisoxazol-3-yl)carbonyl]amino\}-4-oxoheptanoyl)amino]-5-[(3S)-2-oxopyrrolidin-3-yl]pentanoate 0
                      gemfibrozil 96
                      mevaldic acid 0
                      oxopentanoic acid + 25
                      p-N,N-bis(2-chloroethyl)aminophenylvaleric acid 0
                      pentanamide + 0
                      pentanoyl-CoA + 0
                      perfluoropentanoic acid 25
                      valeryl group 0
                      valproic acid + 14502
    Path 2
    Term Annotations click to browse term
      CHEBI ontology 19876
        subatomic particle 19874
          composite particle 19874
            hadron 19874
              baryon 19874
                nucleon 19874
                  atomic nucleus 19905
                    atom 19905
                      main group element atom 19821
                        p-block element atom 19821
                          carbon group element atom 19768
                            carbon atom 19764
                              organic molecular entity 19764
                                organic group 18962
                                  organic divalent group 18943
                                    organodiyl group 18915
                                      carbonyl group 18869
                                        carbonyl compound 18869
                                          carboxylic acid 18618
                                            monocarboxylic acid 17917
                                              fatty acid 16580
                                                saturated fatty acid 16267
                                                  straight-chain saturated fatty acid 15733
                                                    valeric acid 14537
                                                      (2R,3R)-2,3-dihydroxy-3-methylpentanoic acid 0
                                                      (2R,3S)-2-hydroxy-3-methylpentanoic acid 0
                                                      (2S)-2-[(R)-1-carboxyethylamino]pentanoic acid 0
                                                      (4R)-4-hydroxypentanoic acid + 0
                                                      (S)-4-amino-5-oxopentanoic acid 0
                                                      1-octadecanoyl-2-pentanoyl-sn-glycero-3-phosphocholine 0
                                                      1-palmitoyl-2-valeroyl-sn-glycero-3-phosphocholine 0
                                                      2,3,4-trihydroxypentanoic acid 0
                                                      2,5-dioxopentanoic acid 0
                                                      2-amino-4-oxopentanoic acid + 0
                                                      2-aminopentanoic acid + 1
                                                      2-hydroxy-4-methylvalerate + 0
                                                      2-hydroxy-4-methylvaleric acid + 1
                                                      2-hydroxypentanoic acid + 0
                                                      2-methyl-3-ketovaleric acid 0
                                                      2-phenylethyl pentanoate 0
                                                      3,5-dihydroxy-3-methylpentanoic acid + 115
                                                      3-hydroxy-3-methyl-2-oxopentanoic acid + 0
                                                      3-hydroxypentanoic acid + 0
                                                      3-methyl-2-oxovaleric acid + 1
                                                      4,5-dioxopentanoic acid 0
                                                      4-hydroxy-2-oxopentanoic acid + 0
                                                      4-methyl-2-oxopentanoic acid 4
                                                      4-methyl-3-oxopentanoic acid 0
                                                      5-(2,3-dimethoxy-4-methylphenyl)pentanoic acid 0
                                                      5-[(1-phenylcyclohexyl)amino]pentanoic acid 0
                                                      5-[(4-nitrobenzyl)(phosphonomethyl)amino]valeric acid 0
                                                      5-\{3-[(2,4-diaminopyrimidin-5-yl)methyl]-4-methoxyphenoxy\}pentanoic acid 0
                                                      5-amino-2-oxopentanoic acid 0
                                                      5-aminopentanoic acid + 0
                                                      5-guanidino-2-oxopentanoic acid 0
                                                      5-guanidino-3-methyl-2-oxopentanoic acid 0
                                                      5-hydroxypentanoic acid + 0
                                                      5-phenylpentanoic acid 0
                                                      O-valeroylcarnitine + 0
                                                      acetylpyruvic acid + 0
                                                      ethyl (4R)-4-[((2R,5S)-2-(4-fluorobenzyl)-6-methyl-5-\{[(5-methylisoxazol-3-yl)carbonyl]amino\}-4-oxoheptanoyl)amino]-5-[(3S)-2-oxopyrrolidin-3-yl]pentanoate 0
                                                      gemfibrozil 96
                                                      mevaldic acid 0
                                                      oxopentanoic acid + 25
                                                      p-N,N-bis(2-chloroethyl)aminophenylvaleric acid 0
                                                      pentanamide + 0
                                                      pentanoyl-CoA + 0
                                                      perfluoropentanoic acid 25
                                                      valeryl group 0
                                                      valproic acid + 14502
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