LIPID MAPS

Structure Database (LMSD)

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Common Name

8-F3t-IsoP

Systematic Name

8S,12S,14R-trihydroxy-5Z,9E,17Z-prostatrienoic acid-cyclo[11S,15R]

Synonyms

LM ID

LMFA03110355

Formula

C₂₀H₃₂O₅

Exact Mass

Calculate m/z

352.224976

Sum Composition

FA 20:4;O3

Status

Curated

Show lipids differing only in stereochemistry/bond geometry

Classification

References

Taxonomy Information

Curated from

NCBI taxonomy class

Reference

synthetic construct (#32630)

Oxygenated metabolites of n-3 polyunsaturated fatty acids as potential oxidative stress biomarkers: total synthesis of 8-F3t-IsoP, 10-F4t-NeuroP and [D4]-10-F4t-NeuroP.,
Chemistry, 2014

Pubmed ID: 24737635

String Representations

InChiKey (Click to copy)

KNYRCWXIALLYKC-FDZRAGPDSA-N

InChi (Click to copy)

InChI=1S/C20H32O5/c1-2-3-6-10-16-17(19(23)14-18(16)22)13-12-15(21)9-7-4-5-8-11-20(24)25/h3-4,6-7,12-13,15-19,21-23H,2,5,8-11,14H2,1H3,(H,24,25)/b6-3-,7-4-,13-12+/t15-,16+,17-,18+,19-/m0/s1

SMILES (Click to copy)

C(CCC/C=C\C[C@H](O)/C=C/[C@@H]1[C@@H](O)C[C@@H](O)[C@@H]1C/C=C\CC)(=O)O