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Biological and Environmental Research Ontology
| Preferred Name | 4-phenylbutyric acid | |
| Synonyms |
gamma-Phenyl-n-butyric acid omega-Phenylbutanoic acid gamma-phenylbutyric acid Benzenebutyric acid 4-Phenyl-n-butyric acid omega-phenylbutyric acid 4-PHENYL-BUTANOIC ACID PBA 4-phenylbutanoic acid |
|
| Definitions |
A monocarboxylic acid the structure of which is that of butyric acid substituted with a phenyl group at C-4. It is a histone deacetylase inhibitor that displays anticancer activity. It inhibits cell proliferation, invasion and migration and induces apoptosis in glioma cells. It also inhibits protein isoprenylation, depletes plasma glutamine, increases production of foetal haemoglobin through transcriptional activation of the gamma-globin gene and affects hPPARgamma activation. |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_41500 |
|
| alternative term |
gamma-Phenyl-n-butyric acid omega-Phenylbutanoic acid gamma-phenylbutyric acid Benzenebutyric acid 4-Phenyl-n-butyric acid omega-phenylbutyric acid 4-PHENYL-BUTANOIC ACID PBA 4-phenylbutanoic acid
|
|
| bearer of |
http://purl.obolibrary.org/obo/CHEBI_35610 http://purl.obolibrary.org/obo/CHEBI_61115 |
|
| charge |
0
|
|
| database_cross_reference |
LINCS:LSM-5751 PMID:21894430 PDBeChem:CLT PMID:21726539 Drug_Central:24 PMID:20399799 PMID:21887297 Reaxys:638180 PMID:21237159 MetaCyc:CPD-14367 PMID:19918981 PMID:22101259 PMID:22359472 HMDB:HMDB0000543 CAS:1821-12-1
|
|
| definition |
A monocarboxylic acid the structure of which is that of butyric acid substituted with a phenyl group at C-4. It is a histone deacetylase inhibitor that displays anticancer activity. It inhibits cell proliferation, invasion and migration and induces apoptosis in glioma cells. It also inhibits protein isoprenylation, depletes plasma glutamine, increases production of foetal haemoglobin through transcriptional activation of the gamma-globin gene and affects hPPARgamma activation.
|
|
| formula |
C10H12O2
|
|
| has_alternative_id |
CHEBI:64058
|
|
| has_exact_synonym |
4-phenylbutanoic acid
|
|
| has_functional_parent | ||
| has_obo_namespace |
chebi_ontology
|
|
| has_related_synonym |
gamma-Phenyl-n-butyric acid omega-Phenylbutanoic acid gamma-phenylbutyric acid Benzenebutyric acid 4-Phenyl-n-butyric acid omega-phenylbutyric acid 4-PHENYL-BUTANOIC ACID PBA
|
|
| id |
CHEBI:41500
|
|
| in_subset | ||
| inchi |
InChI=1S/C10H12O2/c11-10(12)8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H,11,12)
|
|
| inchikey |
OBKXEAXTFZPCHS-UHFFFAOYSA-N
|
|
| is_conjugate_acid_of | ||
| label |
4-phenylbutyric acid
|
|
| mass |
164.20110
|
|
| monoisotopicmass |
164.08373
|
|
| notation |
CHEBI:41500
|
|
| prefLabel |
4-phenylbutyric acid
|
|
| RO_0000087 |
http://purl.obolibrary.org/obo/CHEBI_35610 http://purl.obolibrary.org/obo/CHEBI_61115 |
|
| smiles |
OC(=O)CCCc1ccccc1
|
|
| subClassOf |
| Delete | Subject | Author | Type | Created |
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| No notes to display |