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CHEBI:84878 - 20-methyldocosanoic acid

ChEBI IDCHEBI:84878
ChEBI Name20-methyldocosanoic acid
Stars
DefinitionA methyl-branched fatty acid that is docosanoic acid (behenic acid) substituted by a methyl group at position 20.
Last Modified18 February 2015
Submitternamrata
DownloadsMolfile
FormulaC23H46O2
Net Charge0
Average Mass354.619
Monoisotopic Mass354.34978
SMILESCCC(C)CCCCCCCCCCCCCCCCCCC(=O)O
InChIInChI=1S/C23H46O2/c1-3-22(2)20-18-16-14-12-10-8-6-4-5-7-9-11-13-15-17-19-21-23(24)25/h22H,3-21H2,1-2H3,(H,24,25)
InChIKeyMZRXKFZYUOFQRH-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
20-methyldocosanoic acid (CHEBI:84878) has functional parent docosanoic acid (CHEBI:28941)
20-methyldocosanoic acid (CHEBI:84878) is a branched-chain saturated fatty acid (CHEBI:39417)
20-methyldocosanoic acid (CHEBI:84878) is a long-chain fatty acid (CHEBI:15904)
20-methyldocosanoic acid (CHEBI:84878) is a methyl-branched fatty acid (CHEBI:62499)
IUPAC Name 
20-methyldocosanoic acid
Synonym  Source
20-methylbehenic acidChEBI
Manual XrefsDatabases
LMFA01020020LIPID MAPS
Registry NumbersSources
Reaxys:1727734Reaxys