LIPID MAPS

Structure Database (LMSD)

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Common Name

15dPGJ2-GS

Systematic Name

11-oxo-9-(S-glutathionyl)-5Z,12E,14E-prostatetraenoic acid

Synonyms

glutathionyl-15-deoxy-delta-12,14-Prostaglandin J2

LM ID

LMFA03010239

Formula

C₃₀H₄₅N₃O₉S

Exact Mass

Calculate m/z

623.287654

Status

Active

Show lipids differing only in stereochemistry/bond geometry

Classification

References

Taxonomy Information

Curated from

NCBI taxonomy class

Reference

Mus musculus (#10090)

Mammalia (#40674)

Biosynthesis of prostaglandin 15dPGJ2 -glutathione and 15dPGJ2-cysteine conjugates in macrophages and mast cells via MGST3,
J Lipid Res, 2022

Pubmed ID: 36370807

DOI: 10.1016/j.jlr.2022.100310

String Representations

InChiKey (Click to copy)

PJVSKAKTGJJITI-YPYHUWNQSA-N

InChi (Click to copy)

InChI=1S/C30H45N3O9S/c1-2-3-4-5-6-9-12-20-21(13-10-7-8-11-14-27(36)37)25(17-24(20)34)43-19-23(29(40)32-18-28(38)39)33-26(35)16-15-22(31)30(41)42/h6-7,9-10,12,21-23,25H,2-5,8,11,13-19,31H2,1H3,(H,32,40)(H,33,35)(H,36,37)(H,38,39)(H,41,42)/b9-6+,10-7-,20-12+/t21-,22+,23+,25?/m1/s1

SMILES (Click to copy)

C1(=C/C=C/CCCCC)\C(=O)CC(SC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)NCC(O)=O)[C@@H]\1C/C=C\CCCC(=O)O