LIPID MAPS

Structure Database (LMSD)

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Common Name

Taxoleic acid

Systematic Name

5Z,9Z-octadecadienoic acid

Synonyms

C18:2n-9,13

LM ID

LMFA01030325

Formula

C₁₈H₃₂O₂

Exact Mass

Calculate m/z

280.240231

Sum Composition

FA 18:2

Status

Curated

Show lipids differing only in stereochemistry/bond geometry

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Classification

Reactions

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References

Taxonomy Information

Curated from

NCBI taxonomy class

Reference

Dictyostelium discoideum (#44689)

Eumycetozoa (#142796)

FATTY ACID AND PHOSPHOLIPID COMPOSITION OF THE CELLULAR SLIME MOLD, DICTYOSTELIUM DISCOIDEUM. THE OCCURRENCE OF PREVIOUSLY UNDESCRIBED FATTY ACIDS.,
J Biol Chem, 1963

Pubmed ID: 14085362

DOI: 10.1016/s0021-9258(18)48647-4

Taxus baccata (#25629)

Pinopsida (#58019)

Taxus baccata seed oil: a new source of cis-5,cis-9-octadecadienoic acid.,
Lipids, 1975

Pubmed ID: 1160526

DOI: 10.1007/bf02532438

String Representations

InChiKey (Click to copy)

DFJAXEWDHVOILU-KWUOUXIESA-N

InChi (Click to copy)

InChI=1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10,13-14H,2-8,11-12,15-17H2,1H3,(H,19,20)/b10-9-,14-13-

SMILES (Click to copy)

C(CCC/C=C\CC/C=C\CCCCCCCC)(=O)O

Other Databases

LIPIDAT ID

5539

CHEBI ID

165493

PubChem CID

5312476

PlantFA ID

10082

Calculated Physicochemical Properties

Heavy Atoms 20

Rings 0

Aromatic Rings 0

Rotatable Bonds 14

Van der Waals Molecular Volume 329.62

Topological Polar Surface Area 37.30

Hydrogen Bond Donors 1

Hydrogen Bond Acceptors 2

logP 5.88

Molar Refractivity 86.99

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Created at

Updated at

25th Apr 2022