Structure Database (LMSD)

Systematic Name
14-hydroxy-7Z,10Z,12E-nonadecatrienoic acid
Synonyms
LM ID
LMFA01050612
Formula
C19H32O3
Exact Mass
Calculate m/z
308.235146
Sum Composition
FA 19:3;O
Status
Curated
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Fatty Acids and Conjugates [FA01]
Hydroxy fatty acids [FA0105]
Unsaturated fatty acids [FA0103]

References

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Homo sapiens (#9606)
Mammalia (#40674)
Metabolism of 7,10,13,16-docosatetraenoic acid to dihomo-thromboxane, 14-hydroxy-7,10,12-nonadecatrienoic acid and hydroxy fatty acids by human platelets.,
Biochim Biophys Acta, 1985
Pubmed ID: 3918572

String Representations

InChiKey (Click to copy)
XCBZVFDTMZYXJG-MMZHUSJISA-N
InChi (Click to copy)
InChI=1S/C19H32O3/c1-2-3-12-15-18(20)16-13-10-8-6-4-5-7-9-11-14-17-19(21)22/h4-5,8,10,13,16,18,20H,2-3,6-7,9,11-12,14-15,17H2,1H3,(H,21,22)/b5-4-,10-8-,16-13+
SMILES (Click to copy)
C(CC(=O)O)CCC/C=C\C/C=C\C=C\C(O)CCCCC

Other Databases

PubChem CID
89057342

Calculated Physicochemical Properties

Heavy Atoms 22
Rings
Aromatic Rings
Rotatable Bonds 14
Van der Waals Molecular Volume 353.07
Topological Polar Surface Area 57.53
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 3
logP 5.31
Molar Refractivity 93.42

Admin

Created at
14th Aug 2025
Updated at
14th Aug 2025