hexadecanoate; (E)-octadec-9-enoate; tetradecanoate

Systemtic Name: hexadecanoate; (E)-octadec-9-enoate; tetradecanoate Openeye Name: hexadecanoate; (E)-octadec-9-enoate; tetradecanoate CAS Name: hexadecanoate; (E)-9-octadecenoate; tetradecanoate IUPAC Name: hexadecanoate; (E)-octadec-9-enoate; tetradecanoate Traditional Name: myristate; (E)-octadec-9-enoate; palmitate Formula: C48H91O6-3 MolecularWeight: 764.23254

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCC(=O)[O-].CCCCCCCCC=CCCCCCCCC(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCC(=O)[O-].CCCCCCCC/C=C/CCCCCCCC(=O)[O-]

InChI

InChI=1S/C18H34O2.C16H32O2.C14H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18;1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h9-10H,2-8,11-17H2,1H3,(H,19,20);2-15H2,1H3,(H,17,18);2-13H2,1H3,(H,15,16)/p-3/b10-9+;;