omega-Carboxy-N-acetyl-LTE4

Molecular Formula: C25H37NO8S


InChI: InChI=1/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/f/h26,29,31,33H

InChIKey: InChIKey=CDLXVLKWNIXANF-KCNLUPOQDM
SMILES: CC(=O)NC(CSC(C=CC=CC=CCC=CCCCCC(=O)O)C(CCCC(=O)O)O)C(=O)O

Names:
    C11629
    omega-Carboxy-N-acetyl-LTE4
    omega-COOH-LTE4NAc
    (6Z,9Z,11E,13E,15R,16S)-15-(2-acetamido-2-carboxy-ethyl)sulfanyl-16-hydroxy-icosa-6,9,11,13-tetraenedioic acid
    (7E,9E,11Z,14Z)-(5S,6R)-6-((N-Acetyl)cystein-S-yl)-5-hydroxyeicosa-7,9,11,14-tetraen-1,20-dioate

Registries:
    PubChem CID 5281956
    PubChem ID 13794