methyl (4R)-2-oxidanylidene-5-phenylmethoxy-4-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienoxy]pentanoate

Systemtic Name: methyl (4R)-2-oxidanylidene-5-phenylmethoxy-4-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienoxy]pentanoate Openeye Name: methyl (4R)-5-benzyloxy-2-oxo-4-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienoxy]pentanoate CAS Name: (4R)-2-oxo-5-phenylmethoxy-4-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienoxy]pentanoic acid methyl ester IUPAC Name: methyl (4R)-2-oxo-5-phenylmethoxy-4-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienoxy]pentanoate Traditional Name: (4R)-5-benzoxy-2-keto-4-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienoxy]valeric acid methyl ester Formula: C28H40O5 MolecularWeight: 456.6142

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CCCC(=CCOC(CC(=O)C(=O)OC)COCC1=CC=CC=C1)C)C)C

Isomeric SMILES

CC(=CCC/C(=C/CC/C(=C/CO[C@H](CC(=O)C(=O)OC)COCC1=CC=CC=C1)/C)/C)C

InChI

InChI=1S/C28H40O5/c1-22(2)11-9-12-23(3)13-10-14-24(4)17-18-33-26(19-27(29)28(30)31-5)21-32-20-25-15-7-6-8-16-25/h6-8,11,13,15-17,26H,9-10,12,14,18-21H2,1-5H3/b23-13+,24-17+/t26-/m1/s1