LIPID MAPS

Structure Database (LMSD)

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Common Name

20-carboxy-N-acetyl-leukotriene E4

Systematic Name

6R-(N-acetyl-S-cysteinyl)-(5S)-hydroxy-(7E,9E,11Z,14Z)-eicosatetraenedioic acid

Synonyms

omega-COOH-LTE4NAc

LM ID

LMFA03020081

Formula

C₂₅H₃₇NO₈S

Exact Mass

Calculate m/z

511.223991

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)

CDLXVLKWNIXANF-WGJURILISA-N

InChi (Click to copy)

InChI=1S/C25H37NO8S/c1-19(27)26-20(25(33)34)18-35-22(21(28)14-13-17-24(31)32)15-11-9-7-5-3-2-4-6-8-10-12-16-23(29)30/h3-7,9,11,15,20-22,28H,2,8,10,12-14,16-18H2,1H3,(H,26,27)(H,29,30)(H,31,32)(H,33,34)/b5-3-,6-4-,9-7+,15-11+/t20-,21-,22+/m0/s1

SMILES (Click to copy)

C(CCC[C@H](O)[C@H](SC[C@H](NC(C)=O)C(=O)O)/C=C/C=C/C=C\C/C=C\CCCCC(=O)O)(=O)O