erucic acid

[1. A 22-carbon unsaturated fatty acid present in the seeds of nasturtium (Indian cress) and of several Cruciferae species (rape, mustard, and wallflower); thought to be toxic to cardiac muscle.

Molecular Formula: C₂₂H₄₂O₂

InChI: InChI=1/C22H42O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h9-10H,2-8,11-21H2,1H3,(H,23,24)/b10-9-/f/h23H

InChIKey: InChIKey=DPUOLQHDNGRHBS-QXGAHKPADI
SMILES: CCCCCCCC\C=C/CCCCCCCCCCCC(O)=O

CAS number 112-86-7

Names:
    cis-Δ13-docosenoic acid
    cis-13-Docosenoic acid
    Erucasäure
    ERUCIC ACID
    Erucic acid
    erucic acid
    (Z)-docos-13-enoic acid
    (Z)-13-docosenoic acid
    (13Z)-Docosenoic acid
    (13Z)-13-docosenoic acid
    13-cis-docosenoic acid
    13-Docosenoic acid, (Z)-

Registries:
    PubChem CID 5281116
    Beilstein =1728049
    CAS 112-86-7 (from NIST)
    ChEBI 28792
    Gmelin 177365
    Kegg C08316
    PubChem ID 10339770
    PubChem ID 10514