[(2E,6R)-2,6-dimethyl-6-oxidanyl-octa-2,7-dienyl] (Z)-octadec-9-enoate

Systemtic Name: [(2E,6R)-2,6-dimethyl-6-oxidanyl-octa-2,7-dienyl] (Z)-octadec-9-enoate Openeye Name: [(2E,6R)-6-hydroxy-2,6-dimethyl-octa-2,7-dienyl] (Z)-octadec-9-enoate CAS Name: (Z)-9-octadecenoic acid [(2E,6R)-6-hydroxy-2,6-dimethylocta-2,7-dienyl] ester IUPAC Name: [(2E,6R)-6-hydroxy-2,6-dimethylocta-2,7-dienyl] (Z)-octadec-9-enoate Traditional Name: (Z)-octadec-9-enoic acid [(2E,6R)-6-hydroxy-2,6-dimethyl-octa-2,7-dienyl] ester Formula: C28H50O3 MolecularWeight: 434.6948

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)OCC(=CCCC(C)(C=C)O)C

Isomeric SMILES

CCCCCCCC/C=C\CCCCCCCC(=O)OC/C(=C/CC[C@](C)(C=C)O)/C

InChI

InChI=1S/C28H50O3/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23-27(29)31-25-26(3)22-21-24-28(4,30)6-2/h6,13-14,22,30H,2,5,7-12,15-21,23-25H2,1,3-4H3/b14-13-,26-22+/t28-/m0/s1