CHEBI:34811 - lactobacillic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name lactobacillic acid
ChEBI ID CHEBI:34811
Definition An 11,12-methyleneoctadecanoic acid having (11R,12S)-configuration.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C19H36O2
Net Charge 0
Average Mass 296.48790
Monoisotopic Mass 296.272
InChI InChI=1S/C19H36O2/c1-2-3-4-10-13-17-16-18(17)14-11-8-6-5-7-9-12-15-19(20)21/h17-18H,2-16H2,1H3,(H,20,21)/t17-,18+/m0/s1
InChIKey IJKRDVKGCQRKBI-ZWKOTPCHSA-N
SMILES CCCCCC[C@H]1C[C@H]1CCCCCCCCCC(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing lactobacillic acid (CHEBI:34811) is a 11,12-methyleneoctadecanoic acid (CHEBI:61456)
IUPAC Name
10-[(1R,2S)-2-hexylcyclopropyl]decanoic acid
Synonyms Sources
(11R,12S)-lactobacillic acid ChEBI
(1R,2S)-1-(9'-carboxynon-1'-yl)-2-hexylcyclopropane ChEBI
(1R,2S)-2-hexylcyclopropanedecanoic acid ChEBI
(R,S)-11,12-methyleneoctadecanoic acid ChEBI
11,12-Mt 18:0 ChEBI
11R,12S-Methylene-octadecanoic acid KEGG COMPOUND
acide-methylene-11R,12S-octadecanoïque ChEBI
C19:0 cyclov8c ChEBI
Lactobacillsäure ChEBI
phytomonic acid ChemIDplus
Phytomonsäure ChEBI
Manual Xrefs Databases
C13838 KEGG COMPOUND
LMFA01140001 LIPID MAPS
View more database links
Registry Numbers Types Sources
2331563 Reaxys Registry Number Reaxys
503-06-0 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
13211606 PubMed citation Europe PMC
14353943 PubMed citation Europe PMC
14402440 PubMed citation Europe PMC
Last Modified
25 February 2011