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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: 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 20856
        role 20816
          biological role 20814
            biochemical role 20261
              metabolite 20243
                eukaryotic metabolite 19957
                  plant metabolite 18265
                    valeric acid 14568
                      (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 + 116
                      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 + 30
                      p-N,N-bis(2-chloroethyl)aminophenylvaleric acid 0
                      pentanamide + 0
                      pentanoyl-CoA + 0
                      perfluoropentanoic acid 26
                      valeryl group 0
                      valproic acid + 14541
    Path 2
    Term Annotations click to browse term
      CHEBI ontology 20856
        subatomic particle 20854
          composite particle 20854
            hadron 20854
              baryon 20854
                nucleon 20854
                  atomic nucleus 20854
                    atom 20854
                      main group element atom 20777
                        p-block element atom 20777
                          carbon group element atom 20710
                            carbon atom 20704
                              organic molecular entity 20704
                                heteroorganic entity 20215
                                  organochalcogen compound 19902
                                    organooxygen compound 19804
                                      carbon oxoacid 19150
                                        carboxylic acid 19147
                                          monocarboxylic acid 18300
                                            fatty acid 16989
                                              saturated fatty acid 16681
                                                straight-chain saturated fatty acid 16198
                                                  valeric acid 14568
                                                    (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 + 116
                                                    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 + 30
                                                    p-N,N-bis(2-chloroethyl)aminophenylvaleric acid 0
                                                    pentanamide + 0
                                                    pentanoyl-CoA + 0
                                                    perfluoropentanoic acid 26
                                                    valeryl group 0
                                                    valproic acid + 14541
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