LIPID MAPS

Structure Database (LMSD)

Download as... MDLMOL SDF CSV TSV PNG SVG

Systematic Name

14-hydroxy-7Z,10Z,12E-nonadecatrienoic acid

Synonyms

LM ID

LMFA01050613

Formula

C₁₉H₃₀O₃

Exact Mass

Calculate m/z

306.219496

Sum Composition

FA 19:4;O

Status

Curated

Show lipids differing only in stereochemistry/bond geometry

Classification

References

Taxonomy Information

Curated from

NCBI taxonomy class

Reference

Homo sapiens (#9606)

Mammalia (#40674)

Metabolism of 4,7,10,13,16-docosapentaenoic acid by human platelet cyclooxygenase and lipoxygenase.,
Biochim Biophys Acta, 1985

Pubmed ID: 3924108

String Representations

InChiKey (Click to copy)

HSVLBUXSCOSFKZ-ABDVSPRGSA-N

InChi (Click to copy)

InChI=1S/C19H30O3/c1-2-3-12-15-18(20)16-13-10-8-6-4-5-7-9-11-14-17-19(21)22/h4-5,8-11,13,16,18,20H,2-3,6-7,12,14-15,17H2,1H3,(H,21,22)/b5-4-,10-8-,11-9-,16-13+

SMILES (Click to copy)

C(CC/C=C\C/C=C\C/C=C\C=C\C(O)CCCCC)(=O)O

Calculated Physicochemical Properties

Heavy Atoms 22

Rings

Aromatic Rings

Rotatable Bonds 13

Van der Waals Molecular Volume 350.43

Topological Polar Surface Area 57.53

Hydrogen Bond Donors 2

Hydrogen Bond Acceptors 3

logP 5.08

Molar Refractivity 93.32

Admin

Created at

14th Aug 2025

Updated at