loading...| Preferred Name |
valeric acid |
|
| Synonyms |
Valeric acid pentanoic acid Valeriansaeure n-Valeric acid propylacetic acid n-Pentanoate CH3-[CH2]3-COOH valeric acid, normal 1-butanecarboxylic acid n-pentanoic acid n-valeric acid Valerianic acid PENTANOIC ACID pentoic acid Pentanoic acid Pentanoate Valerate n-BuCOOH |
|
| Definitions |
A straight-chain saturated fatty acid containing five carbon atoms. |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_17418 |
|
| charge |
0 |
|
| database_cross_reference |
CAS:109-52-4 PMID:20507156 DrugBank:DB02406 Gmelin:26714 PDBeChem:LEA Reaxys:969454 Beilstein:969454 HMDB:HMDB0000892 Wikipedia:Valeric_acid KEGG:C00803 LIPID_MAPS_instance:LMFA01010005 KNApSAcK:C00001208 PPDB:3130 |
|
| formula |
C5H10O2 |
|
| has role | ||
| has_alternative_id |
CHEBI:27263 CHEBI:27264 CHEBI:43606 CHEBI:113448 CHEBI:44803 CHEBI:7980 |
|
| has_exact_synonym |
Valeric acid pentanoic acid |
|
| has_obo_namespace |
chebi_ontology |
|
| has_related_synonym |
Valeriansaeure n-Valeric acid propylacetic acid n-Pentanoate CH3-[CH2]3-COOH valeric acid, normal 1-butanecarboxylic acid n-pentanoic acid n-valeric acid Valerianic acid PENTANOIC ACID pentoic acid Pentanoic acid Pentanoate Valerate n-BuCOOH |
|
| 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 |
|
| textual definition |
A straight-chain saturated fatty acid containing five carbon atoms. |
|
| subClassOf |