Structure database (LMSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
LM IDLMFA01020021
Common Name22-methyl-tricosanoic acid
Systematic Name22-methyl-tricosanoic acid
Synonyms-
Exact Mass
368.3654 (neutral)    Calculate m/z:
FormulaC24H48O2
CategoryFatty Acyls [FA]
Main ClassFatty Acids and Conjugates [FA01]
Sub ClassBranched fatty acids [FA0102]
LIPIDBANK IDDFA0246
PubChem CID5282605
InChIKeyKGHVQLDYCDULEN-UHFFFAOYSA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C24H48O2/c1-23(2)21-19-17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20-22-2
4(25)26/h23H,3-22H2,1-2H3,(H,25,26)
SMILESC(CCCCCCCCCCCCC(=O)O)CCCCCCCC(C)C
StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms26Rings0Aromatic Rings0Rotatable Bonds21
 van der Waals
Molecular Volume
438.70Topological Polar
Surface Area
37.30Hydrogen
Bond Donors
1Hydrogen
Bond Acceptors
2
 logP8.53Molar
Refractivity
114.81