2-ethyl-6-[(2S,3S,4S,5R,6R)-5-[(4-methoxyphenyl)methoxy]-4,6-dimethyl-3,7-bis(oxidanyl)heptan-2-yl]-3,5-dimethyl-pyran-4-one

Systemtic Name: 2-ethyl-6-[(2S,3S,4S,5R,6R)-5-[(4-methoxyphenyl)methoxy]-4,6-dimethyl-3,7-bis(oxidanyl)heptan-2-yl]-3,5-dimethyl-pyran-4-one Openeye Name: 2-[(1S,2S,3S,4R,5R)-2,6-dihydroxy-4-[(4-methoxyphenyl)methoxy]-1,3,5-trimethyl-hexyl]-6-ethyl-3,5-dimethyl-pyran-4-one CAS Name: 2-[(2S,3S,4S,5R,6R)-3,7-dihydroxy-5-[(4-methoxyphenyl)methoxy]-4,6-dimethylheptan-2-yl]-6-ethyl-3,5-dimethyl-4-pyranone IUPAC Name: 2-[(2S,3S,4S,5R,6R)-3,7-dihydroxy-5-[(4-methoxyphenyl)methoxy]-4,6-dimethylheptan-2-yl]-6-ethyl-3,5-dimethylpyran-4-one Traditional Name: 2-[(1S,2S,3S,4R,5R)-2,6-dihydroxy-1,3,5-trimethyl-4-p-anisyloxy-hexyl]-6-ethyl-3,5-dimethyl-pyran-4-one Formula: C26H38O6 MolecularWeight: 446.57632

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)C(=C(O1)C(C)C(C(C)C(C(C)CO)OCC2=CC=C(C=C2)OC)O)C)C

Isomeric SMILES

CCC1=C(C(=O)C(=C(O1)[C@@H](C)[C@H]([C@H](C)[C@@H]([C@H](C)CO)OCC2=CC=C(C=C2)OC)O)C)C

InChI

InChI=1S/C26H38O6/c1-8-22-16(3)23(28)18(5)26(32-22)19(6)24(29)17(4)25(15(2)13-27)31-14-20-9-11-21(30-7)12-10-20/h9-12,15,17,19,24-25,27,29H,8,13-14H2,1-7H3/t15-,17+,19+,24+,25-/m1/s1