Record Information
Version1.0
Creation date2011-04-11 17:01:51 UTC
Update date2019-11-26 03:20:55 UTC
Primary IDFDB021827
Secondary Accession NumbersNot Available
Chemical Information
FooDB NameBovinic acid
DescriptionBovinic acid is a conjugated linoleic acid, present in human adipose tissue; the amount of bovinic acid in humans is significantly related to milk fat intake. Conjugated linoleic acids (CLAs) are a group of naturally occurring fatty acids present mainly in fats from ruminants. Milk contains over 20 isomers of CLA but the predominant one is cis-9,trans-11-CLA (bovinic acid). Biomedical studies with animal models have shown that this isomer has anticarcinogenic and anti-atherogenic activities. Bovinic acid is produced as an intermediate in the rumen biohydrogenation of linoleic acid but not of linolenic acid. However, it is only a transient intermediate, and the major source of milk fat CLA is from endogenous synthesis. (PMID 10393134, 15736916) [HMDB]
CAS Number2540-56-9
Structure
Thumb
Synonyms
SynonymSource
(9Z,11e)-Conjugated linoleic acidHMDB
(9Z,11e)-Octadeca-9,11-dienoateHMDB
(9Z,11e)-Octadeca-9,11-dienoic acidHMDB
(9Z,11e)-OctadecadienoateGenerator
(9Z,11e)-Octadecadienoic acidChEBI
(Z,e)-Octadeca-9,11-dienoateGenerator
(Z,e)-Octadeca-9,11-dienoic acidChEBI
9-cis-11-trans-LinoleateGenerator
9-cis-11-trans-Linoleic acidChEBI
9-cis,11-trans-OctadecadienoateHMDB
9-cis,11-trans-Octadecadienoic acidHMDB
9-cis,11-trans-Octadecadienoic acid solutionHMDB
9,11-cis,trans-OctadecanoateGenerator
9,11-cis,trans-Octadecanoic acidChEBI
9(Z),11(e)-OctadecadienoateGenerator
9(Z),11(e)-Octadecadienoic acidChEBI
9Z,11e-CLAHMDB
9Z,11e-OctadecadienoateHMDB
9Z,11e-Octadecadienoic acidHMDB
C18:2, N-7,9 trans,cisChEBI
cis-9, trans-11-OctadecadienoateHMDB
cis-9, trans-11-Octadecadienoic acidHMDB
cis-9,trans-11 Conjugated linoleateGenerator
cis-9,trans-11 Conjugated linoleic acidChEBI
cis-9,trans-11-CLAChEBI
Conjugated (9Z,11e)-linoleic acid solutionHMDB
RumenateGenerator
Rumenic acidChEBI
Predicted PropertiesNot Available
Chemical FormulaC18H32O2
IUPAC name
InChI IdentifierInChI=1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h7-10H,2-6,11-17H2,1H3,(H,19,20)/b8-7-,10-9+
InChI KeyJBYXPOFIGCOSSB-UQGDGPGGSA-N
Isomeric SMILESCCCCCC\C=C/C=C/CCCCCCCC(O)=O
Average Molecular Weight280.4455
Monoisotopic Molecular Weight280.240230268
Classification
ClassificationNot classified
Ontology
OntologyNo ontology term
Physico-Chemical Properties - Experimental
Physico-Chemical Properties - Experimental
PropertyValueReference
Physical stateSolid
Physical DescriptionNot Available
Mass CompositionNot Available
Melting PointNot Available
Boiling PointNot Available
Experimental Water SolubilityNot Available
Experimental logPNot Available
Experimental pKaNot Available
Isoelectric pointNot Available
ChargeNot Available
Optical RotationNot Available
Spectroscopic UV DataNot Available
DensityNot Available
Refractive IndexNot Available
Spectra
Spectra
EI-MS/GC-MSNot Available
MS/MSNot Available
NMRNot Available
ChemSpider ID4444245
ChEMBL IDNot Available
KEGG Compound IDC04056
Pubchem Compound ID5280644
Pubchem Substance IDNot Available
ChEBI IDNot Available
Phenol-Explorer IDNot Available
DrugBank IDNot Available
HMDB IDHMDB03797
CRC / DFC (Dictionary of Food Compounds) IDCPL06-D:CPL10-A
EAFUS IDNot Available
Dr. Duke IDNot Available
BIGG IDNot Available
KNApSAcK IDNot Available
HET IDNot Available
Food Biomarker OntologyNot Available
VMH IDNot Available
Flavornet IDNot Available
GoodScent IDNot Available
SuperScent IDNot Available
Wikipedia IDNot Available
Phenol-Explorer Metabolite IDNot Available
Duplicate IDSNot Available
Old DFC IDSNot Available
Associated Foods
FoodContent Range AverageReference
FoodReference
Biological Effects and Interactions
Health Effects / BioactivitiesNot Available
EnzymesNot Available
PathwaysNot Available
MetabolismNot Available
BiosynthesisNot Available
Organoleptic Properties
FlavoursNot Available
Files
MSDSshow
References
Synthesis ReferenceNot Available
General ReferenceNot Available
Content Reference