(Z,13S)-13-oxidanyloctadec-9-en-11-ynoic acid

Systemtic Name: (Z,13S)-13-oxidanyloctadec-9-en-11-ynoic acid Openeye Name: (Z,13S)-13-hydroxyoctadec-9-en-11-ynoic acid CAS Name: (Z,13S)-13-hydroxyoctadec-9-en-11-ynoic acid IUPAC Name: (Z,13S)-13-hydroxyoctadec-9-en-11-ynoic acid Traditional Name: (Z,13S)-13-hydroxyoctadec-9-en-11-ynoic acid Formula: C18H30O3 MolecularWeight: 294.429

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C#CC=CCCCCCCCC(=O)O)O

Isomeric SMILES

CCCCC[C@@H](C#C/C=C\CCCCCCCC(=O)O)O

InChI

InChI=1S/C18H30O3/c1-2-3-11-14-17(19)15-12-9-7-5-4-6-8-10-13-16-18(20)21/h7,9,17,19H,2-6,8,10-11,13-14,16H2,1H3,(H,20,21)/b9-7-/t17-/m0/s1