Structure database (LMSD)

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LM IDLMFA01050179
Common Name14-hydroxy-12Z-tetradecenoic acid
Systematic Name14-hydroxy-12Z-tetradecenoic acid
Synonyms-
Exact Mass
242.1882 (neutral)    Calculate m/z:
FormulaC14H26O3
CategoryFatty Acyls [FA]
Main ClassFatty Acids and Conjugates [FA01]
Sub ClassHydroxy fatty acids [FA0105]
Alternative ClassesUnsaturated fatty acids[FA0103]
AbbrevFA 14:1;O
LIPIDAT ID4979
PubChem CID5312753
InChIKeyICTIYYVVZNILKD-LUAWRHEFSA-N  Show lipids differing only in stereochemistry/bond geometry
InChI
InChI=1S/C14H26O3/c15-13-11-9-7-5-3-1-2-4-6-8-10-12-14(16)17/h9,11,15H,1-8,10,12-13H2,(H,16,17)/b11-9-
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SMILES
C(CCCCCCCCCC/C=C\CO)(=O)O
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StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms17Rings0Aromatic Rings0Rotatable Bonds12
 van der Waals
Molecular Volume
271.85Topological Polar
Surface Area
57.53Hydrogen
Bond Donors
2Hydrogen
Bond Acceptors
3
 logP3.81Molar
Refractivity
70.52