Structure database (LMSD)

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LM IDLMFA01030177
Common Name4,7,10,13-docosatetraenoic acid
Systematic Name4,7,10,13-docosatetraenoic acid
SynonymsC22:4n-9,12,15,18
Exact Mass
332.2715 (neutral)    Calculate m/z:
FormulaC22H36O2
CategoryFatty Acyls [FA]
Main ClassFatty Acids and Conjugates [FA01]
Sub ClassUnsaturated fatty acids [FA0103]
AbbrevFA 22:4
LIPIDBANK IDDFA0216
PubChem CID5282843
CHEBI ID165467
InChIKeyWSCPRLMTEVITJR-WFYBHXQRSA-N  Show lipids differing only in stereochemistry/bond geometry
InChI
InChI=1S/C22H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h9-10,12-13,15-16,18-19H,2-8,11,14,17,20-21H2,1H3,(H,23,24)/b10-9+,13-12+,16-15+,19-18+
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SMILES
C(=C/C/C=C/CCCCCCCC)\C/C=C/C/C=C/CCC(=O)O
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StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms24Rings0Aromatic Rings0Rotatable Bonds16
 van der Waals
Molecular Volume
393.54Topological Polar
Surface Area
37.30Hydrogen
Bond Donors
1Hydrogen
Bond Acceptors
2
 logP7.00Molar
Refractivity
105.27