LIPID MAPS

Structure Database (LMSD)

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Common Name

Pseudo-LTE

Systematic Name

5,8-dihydroxy-6-(S-cysteinyl)-octanoic acid

Synonyms

LM ID

LMFA03020094

Formula

C₁₁H₂₁NO₆S

Exact Mass

Calculate m/z

295.10896

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)

Radical-induced lipid oxidation produces a torrent of leukotriene-like agonists in severe asthma.,
J Allergy Clin Immunol, 2026

Pubmed ID: 41101738

DOI: 10.1016/j.jaci.2025.09.027

String Representations

InChiKey (Click to copy)

NIJLCRXMFJOROX-UEJVZZJDSA-N

InChi (Click to copy)

InChI=1S/C11H21NO6S/c12-7(11(17)18)6-19-9(4-5-13)8(14)2-1-3-10(15)16/h7-9,13-14H,1-6,12H2,(H,15,16)(H,17,18)/t7-,8?,9?/m0/s1

SMILES (Click to copy)

C(=O)(O)[C@@H](N)CSC(C(O)CCCC(O)=O)CCO

Calculated Physicochemical Properties

Heavy Atoms 19

Rings

Aromatic Rings

Rotatable Bonds 11

Van der Waals Molecular Volume 275.83

Topological Polar Surface Area 141.08

Hydrogen Bond Donors 5

Hydrogen Bond Acceptors 7

logP 0.93

Molar Refractivity 73.57

Admin

Created at

27th Jan 2026

Updated at