InCHi String:
InChI=1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10H,2-5,8,11-17H2,1H3,(H,19,20)/b7-6-,10-9-
canonical SMILES: CCCCCC=CCC=CCCCCCCCC(=O)O
isomeric SMILES: CCCCC\C=C/C\C=C/CCCCCCCC(=O)O
PUBCHEM iupac NAME: PUBCHEM iupac TRADITIONAL NAME: PUBCHEM iupac OPENEYE NAME: PUBCHEM iupac CAS NAME: PUBCHEM iupac SYSTEMATIC NAME(9Z,12Z)-octadeca-9,12-dienoic acid
PubChem Substance (SID):
111677745 48110221 48425246PubChem Compound (CID):
5280450KEGG: Compound ID
C01595CAS Registry IDs: 60-33-3
PDB Chemical Component
EICMiscellaneous Databases and IDs:
Sigma-Aldrich L1376_SIGMA
ChEBI CHEBI:17351 EPA DSSTox 33609
ChemBank BSPBio_001374
LipidMAPS LMFA01030120
SMID EIC
MMDB 60542.3
NIST Chemistry WebBook 353550409
MMCD cq_01041
MDL MFCD00064241
Reference data were obtained primarily from the PubChem database.
Three dimensional molecular rendering uses Jmol.
