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Biological and Environmental Research Ontology
| Preferred Name | valproic acid | |
| Synonyms |
valproic acid 2-propylpentanoic acid Di-n-propylessigsaeure 2-PROPYL-PENTANOIC ACID 2-propylvaleric acid acido valproico Valproinsaeure 2-n-propyl-n-valeric acid di-n-propylacetic acid dipropylacetic acid acide valproique acidum valproicum 4-heptanecarboxylic acid DPA Depakene VPA n-DPA VALPROIC ACID |
|
| Definitions |
A branched-chain saturated fatty acid that comprises of a propyl substituent on a pentanoic acid stem. |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_39867 |
|
| alternative term |
valproic acid 2-propylpentanoic acid Di-n-propylessigsaeure 2-PROPYL-PENTANOIC ACID 2-propylvaleric acid acido valproico Valproinsaeure 2-n-propyl-n-valeric acid di-n-propylacetic acid dipropylacetic acid acide valproique acidum valproicum 4-heptanecarboxylic acid DPA Depakene VPA n-DPA VALPROIC ACID
|
|
| bearer of |
http://purl.obolibrary.org/obo/CHEBI_50905 http://purl.obolibrary.org/obo/CHEBI_35477 http://purl.obolibrary.org/obo/CHEBI_51374 http://purl.obolibrary.org/obo/CHEBI_61115 |
|
| charge |
0
|
|
| database_cross_reference |
PMID:8558327 PMID:11716839 PMID:16759735 Reaxys:1750447 Beilstein:1750447 KEGG:D00399 Drug_Central:2803 PMID:19318486 CAS:99-66-1 PMID:16496131 DrugBank:DB00313 LINCS:LSM-4620 PMID:16621443 PMID:24135375 PMID:23792104 PMID:15578701 PMID:17273758 Wikipedia:Valproic_Acid PDBeChem:2PP PMID:12475192 KEGG:C07185 PMID:15560954 PMID:17156483 PMID:15124690 PMID:19280426 LIPID_MAPS_instance:LMFA01020291 PMID:23810771 PMID:8681902 HMDB:HMDB0001877 PMID:23949302 PMID:24348849 PMID:24200999
|
|
| definition |
A branched-chain saturated fatty acid that comprises of a propyl substituent on a pentanoic acid stem.
|
|
| formula |
C8H16O2
|
|
| has_alternative_id |
CHEBI:115217 CHEBI:39858 CHEBI:9926
|
|
| has_exact_synonym |
2-propylpentanoic acid VALPROIC ACID
|
|
| has_functional_parent | ||
| has_obo_namespace |
chebi_ontology
|
|
| has_related_synonym |
valproic acid 2-propylpentanoic acid Di-n-propylessigsaeure 2-PROPYL-PENTANOIC ACID 2-propylvaleric acid acido valproico Valproinsaeure 2-n-propyl-n-valeric acid di-n-propylacetic acid dipropylacetic acid acide valproique acidum valproicum 4-heptanecarboxylic acid DPA Depakene VPA n-DPA
|
|
| id |
CHEBI:39867
|
|
| in_subset | ||
| inchi |
InChI=1S/C8H16O2/c1-3-5-7(6-4-2)8(9)10/h7H,3-6H2,1-2H3,(H,9,10)
|
|
| inchikey |
NIJJYAXOARWZEE-UHFFFAOYSA-N
|
|
| is_conjugate_acid_of | ||
| label |
valproic acid
|
|
| mass |
144.21140
|
|
| monoisotopicmass |
144.11503
|
|
| notation |
CHEBI:39867
|
|
| prefLabel |
valproic acid
|
|
| RO_0000087 |
http://purl.obolibrary.org/obo/CHEBI_50905 http://purl.obolibrary.org/obo/CHEBI_35477 http://purl.obolibrary.org/obo/CHEBI_51374 http://purl.obolibrary.org/obo/CHEBI_61115 |
|
| smiles |
CCCC(CCC)C(O)=O
|
|
| subClassOf |
| Delete | Subject | Author | Type | Created |
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| No notes to display |