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Neuroscience Information Framework (NIF) Standard Ontology
Last uploaded:
February 10, 2018
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| Preferred Name | valproate | |
| Synonyms |
dipropylacetate 2-propylvalerate 2-propylpentanoate |
|
| Definitions |
A branched-chain saturated fatty acid anion that is the conjugate base of valproic acid. |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_60654 |
|
| alternative label |
dipropylacetate 2-propylvalerate 2-propylpentanoate
|
|
| charge |
-1
|
|
| database_cross_reference |
PMID:16012283 LINCS:LSM-6363 PMID:21161183 PMID:21767635 PMID:21167688 PMID:21629819 PMID:21243535 PMID:21454832 PMID:21593515 PMID:8681902 PMID:21472635 PMID:21459656 PMID:20633966
|
|
| definition |
A branched-chain saturated fatty acid anion that is the conjugate base of valproic acid.
|
|
| formula |
C8H15O2
|
|
| has characteristic | ||
| has exact synonym |
2-propylpentanoate
|
|
| has functional parent | ||
| has role | ||
| has_alternative_id |
CHEBI:68615
|
|
| has_obo_namespace |
chebi_ontology
|
|
| has_related_synonym |
dipropylacetate 2-propylvalerate
|
|
| id |
CHEBI:60654
|
|
| in_subset | ||
| inchi |
InChI=1S/C8H16O2/c1-3-5-7(6-4-2)8(9)10/h7H,3-6H2,1-2H3,(H,9,10)/p-1
|
|
| inchikey |
NIJJYAXOARWZEE-UHFFFAOYSA-M
|
|
| is conjugate base of | ||
| label |
valproate
|
|
| mass |
143.20350
|
|
| monoisotopicmass |
143.10775
|
|
| notation |
CHEBI:60654
|
|
| note |
A branched-chain saturated fatty acid anion that is the conjugate base of valproic acid.
|
|
| preferred label |
valproate
|
|
| prefLabel |
valproate
|
|
| smiles |
CCCC(CCC)C([O-])=O
|
|
| subClassOf |
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