Structure database (LMSD)

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LM IDLMFA01050047
Common Name2-hydroxy palmitic acid
Systematic Name2-hydroxy-hexadecanoic acid
Synonyms-
Exact Mass
272.2351 (neutral)    Calculate m/z:
FormulaC16H32O3
CategoryFatty Acyls [FA]
Main ClassFatty Acids and Conjugates [FA01]
Sub ClassHydroxy fatty acids [FA0105]
LIPIDBANK IDDFA0313
PubChem CID92836
PlantFA ID10257
SWISSLIPIDS IDSLM:000000389
CAYMAN ID22679
InChIKeyJGHSBPIZNUXPLA-UHFFFAOYSA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C16H32O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15(17)16(18)19/h15,17H,2-14H
2,1H3,(H,18,19)
SMILESC(CCCCCCCCCCCCC)C(O)C(=O)O
MS Spectra-     
StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms19Rings0Aromatic Rings0Rotatable Bonds14
 van der Waals
Molecular Volume
309.09Topological Polar
Surface Area
57.53Hydrogen
Bond Donors
2Hydrogen
Bond Acceptors
3
 logP4.81Molar
Refractivity
79.85