[(1R,3E,7E)-4-(acetyloxymethyl)-8-methyl-1-(5-oxidanylidene-2H-furan-3-yl)-10-(2,6,6-trimethylcyclohexen-1-yl)deca-3,7-dienyl] 2-phenylbutanoate

Systemtic Name: [(1R,3E,7E)-4-(acetyloxymethyl)-8-methyl-1-(5-oxidanylidene-2H-furan-3-yl)-10-(2,6,6-trimethylcyclohexen-1-yl)deca-3,7-dienyl] 2-phenylbutanoate Openeye Name: [(1R,3E,7E)-4-(acetoxymethyl)-8-methyl-1-(5-oxo-2H-furan-3-yl)-10-(2,6,6-trimethylcyclohexen-1-yl)deca-3,7-dienyl] 2-phenylbutanoate CAS Name: 2-phenylbutanoic acid [(1R,3E,7E)-4-(acetyloxymethyl)-8-methyl-1-(5-oxo-2H-furan-3-yl)-10-(2,6,6-trimethyl-1-cyclohexenyl)deca-3,7-dienyl] ester IUPAC Name: [(1R,3E,7E)-4-(acetyloxymethyl)-8-methyl-1-(5-oxo-2H-furan-3-yl)-10-(2,6,6-trimethylcyclohexen-1-yl)deca-3,7-dienyl] 2-phenylbutanoate Traditional Name: 2-phenylbutyric acid [(1R,3E,7E)-4-(acetoxymethyl)-1-(5-keto-2H-furan-3-yl)-8-methyl-10-(2,6,6-trimethylcyclohexen-1-yl)deca-3,7-dienyl] ester Formula: C37H50O6 MolecularWeight: 590.7893

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)OC(CC=C(CCC=C(C)CCC2=C(CCCC2(C)C)C)COC(=O)C)C3=CC(=O)OC3

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)O[C@H](C/C=C(\CC/C=C(\C)/CCC2=C(CCCC2(C)C)C)/COC(=O)C)C3=CC(=O)OC3

InChI

InChI=1S/C37H50O6/c1-7-32(30-16-9-8-10-17-30)36(40)43-34(31-23-35(39)42-25-31)21-19-29(24-41-28(4)38)15-11-13-26(2)18-20-33-27(3)14-12-22-37(33,5)6/h8-10,13,16-17,19,23,32,34H,7,11-12,14-15,18,20-22,24-25H2,1-6H3/b26-13+,29-19+/t32?,34-/m1/s1