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Chemical Entities of Biological Interest Ontology
Last uploaded:
January 1, 2025
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| Preferred Name | valeric acid | |
| Synonyms |
CH3-[CH2]3-COOH pentoic acid n-pentanoic acid valeric acid, normal Pentanoate propylacetic acid Valerianic acid Valerate n-BuCOOH n-Pentanoate Valeriansaeure 1-butanecarboxylic acid Pentanoic acid PENTANOIC ACID n-Valeric acid n-valeric acid Valeric acid pentanoic acid |
|
| Definitions |
A straight-chain saturated fatty acid containing five carbon atoms. |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_17418 |
|
| charge |
0
|
|
| database_cross_reference |
LIPID_MAPS_instance:LMFA01010005 PPDB:3130 PMID:20507156 Gmelin:26714 Wikipedia:Valeric_acid PDBeChem:LEA Reaxys:969454 KEGG:C00803 CAS:109-52-4 DrugBank:DB02406 HMDB:HMDB0000892 KNApSAcK:C00001208
|
|
| definition |
A straight-chain saturated fatty acid containing five carbon atoms.
|
|
| formula |
C5H10O2
|
|
| has role | ||
| has_alternative_id |
CHEBI:44803 CHEBI:27264 CHEBI:7980 CHEBI:43606 CHEBI:27263 CHEBI:113448
|
|
| has_exact_synonym |
Valeric acid pentanoic acid
|
|
| has_obo_namespace |
chebi_ontology
|
|
| has_related_synonym |
CH3-[CH2]3-COOH pentoic acid n-pentanoic acid valeric acid, normal Pentanoate propylacetic acid Valerianic acid Valerate n-BuCOOH n-Pentanoate Valeriansaeure 1-butanecarboxylic acid Pentanoic acid PENTANOIC ACID n-Valeric acid n-valeric acid
|
|
| id |
CHEBI:17418
|
|
| in_subset | ||
| inchi |
InChI=1S/C5H10O2/c1-2-3-4-5(6)7/h2-4H2,1H3,(H,6,7)
|
|
| inchikey |
NQPDZGIKBAWPEJ-UHFFFAOYSA-N
|
|
| is conjugate acid of | ||
| label |
valeric acid
|
|
| mass |
102.13170
|
|
| monoisotopicmass |
102.06808
|
|
| notation |
CHEBI:17418
|
|
| prefLabel |
valeric acid
|
|
| smiles |
CCCCC(O)=O
|
|
| treeView | ||
| subClassOf |
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