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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:gamma-valerolactone
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Accession:CHEBI:48569 term browser browse the term
Definition:A butan-4-olide that is dihydrofuran-2(3H)-one substituted by a methyl group at position 5. It has been found in the urine samples of humans exposed to n-hexane.
Synonyms:exact_synonym: 5-methyldihydrofuran-2(3H)-one
 related_synonym: 4-Hydroxypentanoic acid lactone;   4-Hydroxyvaleric acid lactone;   4-Methyl-4-hydroxybutanoic acid lactone;   4-Methyl-gamma-butyrolactone;   4-Pentanolide;   4-Valerolactone;   Formula=C5H8O2;   InChI=1S/C5H8O2/c1-4-2-3-5(6)7-4/h4H,2-3H2,1H3;   InChIKey=GAEKPEKOJKCEMS-UHFFFAOYSA-N;   SMILES=CC1CCC(=O)O1;   dihydro-5-methyl-2(3H)-furanone;   gamma-Pentalactone;   gamma-Pentanolactone
 xref: Beilstein:80420;   CAS:108-29-2;   HMDB:HMDB0033840
 xref_mesh: MESH:C037556
 xref: PMID:23486087;   PMID:7470400;   Patent:CN101633649;   Reaxys:80420;   Wikipedia:Gamma-Valerolactone


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gamma-valerolactone term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Cyp1a2 cytochrome P450, family 1, subfamily a, polypeptide 2 decreases activity ISO gamma-valerolactone results in decreased activity of CYP1A2 protein CTD PMID:15916432 NCBI chr 8:58,075,367...58,082,255
Ensembl chr 8:58,075,367...58,082,312 		JBrowse link
Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19932
    role 19904
      application 19741
        food additive 16193
          flavouring agent 4862
            gamma-valerolactone 1
              (R)-gamma-valerolactone 0
              (S)-gamma-valerolactone 0
              5-(3',4',5'-trihydroxyphenyl)-gamma-valerolactone 0
              5-(3',4'-dihydroxyphenyl)-gamma-valerolactone 3'-O-sulfate 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19932
    subatomic particle 19930
      composite particle 19930
        hadron 19930
          baryon 19930
            nucleon 19930
              atomic nucleus 19930
                atom 19930
                  main group element atom 19876
                    p-block element atom 19876
                      carbon group element atom 19816
                        carbon atom 19812
                          organic molecular entity 19812
                            heteroorganic entity 19559
                              organochalcogen compound 19317
                                organooxygen compound 19231
                                  ester 17490
                                    carboxylic ester 16773
                                      lactone 13307
                                        gamma-lactone 6864
                                          butan-4-olide 309
                                            gamma-valerolactone 1
                                              (R)-gamma-valerolactone 0
                                              (S)-gamma-valerolactone 0
                                              5-(3',4',5'-trihydroxyphenyl)-gamma-valerolactone 0
                                              5-(3',4'-dihydroxyphenyl)-gamma-valerolactone 3'-O-sulfate 0
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