Structure database (LMSD)

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LM IDLMFA01030056
Common Namecis-9-palmitoleic acid (W)
Systematic Name9Z-hexadecenoic acid
Synonymscis-9-hexadecenoic acid; 9Z-palmitoleic acid; C16:1n-7; Physetoleic acid;
Zoomaric acid; Palmitoleic acid; cis-Palmitoleic acid; Oleopalmitic acid;
Zoomeric acid
Exact Mass
254.2246 (neutral)    Calculate m/z:
FormulaC16H30O2
CategoryFatty Acyls [FA]
Main ClassFatty Acids and Conjugates [FA01]
Sub ClassUnsaturated fatty acids [FA0103]
LIPIDBANK IDDFA0095
PubChem CID445638
KEGG IDC08362
HMDB IDHMDB0003229
CHEBI ID28716
PlantFA ID10051
SWISSLIPIDS IDSLM:000000411
CAYMAN ID10009871
InChIKeySECPZKHBENQXJG-FPLPWBNLSA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C16H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h7-8H,2-6,9-15H2
,1H3,(H,17,18)/b8-7-
SMILESC(CCCCCCC(=O)O)/C=C\CCCCCC
MS SpectraView MoNA MS spectra     
StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms18Rings0Aromatic Rings0Rotatable Bonds13
 van der Waals
Molecular Volume
297.66Topological Polar
Surface Area
37.30Hydrogen
Bond Donors
1Hydrogen
Bond Acceptors
2
 logP5.33Molar
Refractivity
77.85