Structure database (LMSD)

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LM IDLMFA03060009
Common Name20-HETE
Systematic Name20-hydroxy-5Z,8Z,11Z,14Z-eicosatetraenoic acid
Synonyms20-hydroxy Arachidonic Acid
Exact Mass
320.2351 (neutral)    Calculate m/z:
FormulaC20H32O3
CategoryFatty Acyls [FA]
Main ClassEicosanoids [FA03]
Sub ClassHydroxy/hydroperoxyeicosatetraenoic acids [FA0306]
Alternative ClassesUnsaturated fatty acids[FA0103], Hydroxy fatty acids[FA0105]
LIPIDBANK IDDFA8141
PubChem CID5283157
KEGG IDC14748
HMDB IDHMDB0005998
CHEBI ID34306
SWISSLIPIDS IDSLM:000000849
CAYMAN ID10007269
InChIKeyNNDIXBJHNLFJJP-DTLRTWKJSA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C20H32O3/c21-19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18-20(22)23/h
1,3-4,6-7,9-10,12,21H,2,5,8,11,13-19H2,(H,22,23)/b3-1-,6-4-,9-7-,12-10-
SMILESC(O)(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCO
MS StandardView lipid standard
StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms23Rings0Aromatic Rings0Rotatable Bonds15
 van der Waals
Molecular Volume
367.73Topological Polar
Surface Area
57.53Hydrogen
Bond Donors
2Hydrogen
Bond Acceptors
3
 logP5.47Molar
Refractivity
97.94