(E)-2,3,12-tris(oxidanyl)octadec-9-enoate

Systemtic Name: (E)-2,3,12-tris(oxidanyl)octadec-9-enoate Openeye Name: (E)-2,3,12-trihydroxyoctadec-9-enoate CAS Name: (E)-2,3,12-trihydroxy-9-octadecenoate IUPAC Name: (E)-2,3,12-trihydroxyoctadec-9-enoate Traditional Name: (E)-2,3,12-trihydroxyoctadec-9-enoate Formula: C18H33O5- MolecularWeight: 329.45162

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC=CCCCCCC(C(C(=O)[O-])O)O)O

Isomeric SMILES

CCCCCCC(C/C=C/CCCCCC(C(C(=O)[O-])O)O)O

InChI

InChI=1S/C18H34O5/c1-2-3-4-9-12-15(19)13-10-7-5-6-8-11-14-16(20)17(21)18(22)23/h7,10,15-17,19-21H,2-6,8-9,11-14H2,1H3,(H,22,23)/p-1/b10-7+