LIPID MAPS

Structure Database (LMSD)

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Common Name

18-carboxy-19,20-dinor-N-acetyl-leukotriene E4

Systematic Name

(4Z,7Z,9E,11E,13R,14S)-13-(N-acetyl-L-cystein-S-yl)-14-hydroxyoctadeca-4,7,9,11-tetraenedioic acid;(4Z,7Z,9E,11E,13R,14S)-13-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}-14-hydroxyoctadeca-4,7,9,11-tetraenedioic acid

Synonyms

18-carboxy-19,20-dinor-N-acetyl-LTE4

LM ID

LMFA03020082

Formula

C₂₃H₃₃NO₈S

Exact Mass

Calculate m/z

483.192691

Status

Active

Show lipids differing only in stereochemistry/bond geometry

Classification

References

Taxonomy Information

Curated from

NCBI taxonomy class

Reference

Rattus norvegicus (#10116)

Mammalia (#40674)

Metabolism of leukotriene E4 in isolated rat hepatocytes. Identification of beta-oxidation products of sulfidopeptide leukotrienes.,
J Biol Chem, 1988

Pubmed ID: 2830262

String Representations

InChiKey (Click to copy)

QGAYARJCHQVTKP-IDMSBJKASA-N

InChi (Click to copy)

InChI=1S/C23H33NO8S/c1-17(25)24-18(23(31)32)16-33-20(19(26)12-11-15-22(29)30)13-9-7-5-3-2-4-6-8-10-14-21(27)28/h2-3,5-9,13,18-20,26H,4,10-12,14-16H2,1H3,(H,24,25)(H,27,28)(H,29,30)(H,31,32)/b3-2-,7-5+,8-6-,13-9+/t18-,19-,20+/m0/s1

SMILES (Click to copy)

C(S[C@H](/C=C/C=C/C=C\C/C=C\CCC(=O)O)[C@@H](O)CCCC(=O)O)[C@H](NC(C)=O)C(O)=O