(E)-8-ethanoyl-9-methanoyl-12-oxidanyl-heptadec-5-enoic acid

Systemtic Name: (E)-8-ethanoyl-9-methanoyl-12-oxidanyl-heptadec-5-enoic acid Openeye Name: (E)-8-acetyl-9-formyl-12-hydroxy-heptadec-5-enoic acid CAS Name: (E)-8-acetyl-9-formyl-12-hydroxy-5-heptadecenoic acid IUPAC Name: (E)-8-acetyl-9-formyl-12-hydroxyheptadec-5-enoic acid Traditional Name: (E)-8-acetyl-9-formyl-12-hydroxy-heptadec-5-enoic acid Formula: C20H34O5 MolecularWeight: 354.48096

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCC(C=O)C(CC=CCCCC(=O)O)C(=O)C)O

Isomeric SMILES

CCCCCC(CCC(C=O)C(C/C=C/CCCC(=O)O)C(=O)C)O

InChI

InChI=1S/C20H34O5/c1-3-4-7-10-18(23)14-13-17(15-21)19(16(2)22)11-8-5-6-9-12-20(24)25/h5,8,15,17-19,23H,3-4,6-7,9-14H2,1-2H3,(H,24,25)/b8-5+