LIPID MAPS

Structure Database (LMSD)

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Common Name

18-epi-18-F3t-IsoP

Systematic Name

12S,14R,18R-trihydroxy-5Z,8Z,13E-prostatrienoic acid-cyclo[11S,15S]

Synonyms

(5Z,8Z)-10-((1S,2R,3R,5S)-3,5-dihydroxy-2-((R,E)-3-hydroxypent-1-en-1-yl)cyclopentyl)deca-5,8-dienoic acid

LM ID

LMFA03110357

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

View spectra on LIPID MAPS Standard Spectra DB

Classification

References

Taxonomy Information

Curated from

NCBI taxonomy class

Reference

synthetic construct (#32630)

Oxylipin Standard

String Representations

InChiKey (Click to copy)

UZZVQCBZVYTESV-GKLFNCRFSA-N

InChi (Click to copy)

InChI=1S/C20H32O5/c1-2-15(21)12-13-17-16(18(22)14-19(17)23)10-8-6-4-3-5-7-9-11-20(24)25/h3,5-6,8,12-13,15-19,21-23H,2,4,7,9-11,14H2,1H3,(H,24,25)/b5-3-,8-6-,13-12+/t15-,16+,17-,18+,19-/m1/s1

SMILES (Click to copy)

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

Calculated Physicochemical Properties

Heavy Atoms 25

Rings 1

Aromatic Rings

Rotatable Bonds 11

Van der Waals Molecular Volume 375.59

Topological Polar Surface Area 97.99

Hydrogen Bond Donors 4

Hydrogen Bond Acceptors 5

logP 3.68

Molar Refractivity 99.59

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Created at

8th May 2025

Updated at