Record Information
Version1.0
StatusDetected and Quantified
Creation Date2021-05-14 21:02:27 UTC
Update Date2022-08-31 06:19:51 UTC
Metabolite IDMMDBc0002806
Metabolite Identification
Common Name16-methyl-9E-nonadecenoic acid
Description16-methyl-9E-nonadecenoic acid belongs to the class of organic compounds known as long-chain fatty acids. These are fatty acids with an aliphatic tail that contains between 13 and 21 carbon atoms. Based on a literature review a significant number of articles have been published on 16-methyl-9E-nonadecenoic acid.
Structure
Synonyms
ValueSource
16-Methyl-9E-nonadecenoateGenerator
Molecular FormulaC20H38O2
Average Mass310.522
Monoisotopic Mass310.287180464
IUPAC Name(9E)-16-methylnonadec-9-enoic acid
Traditional Name(9E)-16-methylnonadec-9-enoic acid
CAS Registry NumberNot Available
SMILES
[H]\C(CCCCCCCC(O)=O)=C(\[H])CCCCCC(C)CCC
InChI Identifier
InChI=1S/C20H38O2/c1-3-16-19(2)17-14-12-10-8-6-4-5-7-9-11-13-15-18-20(21)22/h4,6,19H,3,5,7-18H2,1-2H3,(H,21,22)/b6-4+
InChI KeySDEKLJPUPCJPTQ-GQCTYLIASA-N