ethyl (E,3R,5R,6R)-9-acetyloxy-5,6-bis[(4-methoxyphenyl)methoxy]-8-methyl-3-oxidanyl-non-7-enoate

Systemtic Name: ethyl (E,3R,5R,6R)-9-acetyloxy-5,6-bis[(4-methoxyphenyl)methoxy]-8-methyl-3-oxidanyl-non-7-enoate Openeye Name: ethyl (E,3R,5R,6R)-9-acetoxy-3-hydroxy-5,6-bis[(4-methoxyphenyl)methoxy]-8-methyl-non-7-enoate CAS Name: (E,3R,5R,6R)-9-acetyloxy-3-hydroxy-5,6-bis[(4-methoxyphenyl)methoxy]-8-methyl-7-nonenoic acid ethyl ester IUPAC Name: ethyl (E,3R,5R,6R)-9-acetyloxy-3-hydroxy-5,6-bis[(4-methoxyphenyl)methoxy]-8-methylnon-7-enoate Traditional Name: (E,3R,5R,6R)-9-acetoxy-3-hydroxy-8-methyl-5,6-bis(p-anisyloxy)non-7-enoic acid ethyl ester Formula: C30H40O9 MolecularWeight: 544.6332

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(CC(C(C=C(C)COC(=O)C)OCC1=CC=C(C=C1)OC)OCC2=CC=C(C=C2)OC)O

Isomeric SMILES

CCOC(=O)C[C@@H](C[C@H]([C@@H](/C=C(\C)/COC(=O)C)OCC1=CC=C(C=C1)OC)OCC2=CC=C(C=C2)OC)O

InChI

InChI=1S/C30H40O9/c1-6-36-30(33)17-25(32)16-29(39-20-24-9-13-27(35-5)14-10-24)28(15-21(2)18-37-22(3)31)38-19-23-7-11-26(34-4)12-8-23/h7-15,25,28-29,32H,6,16-20H2,1-5H3/b21-15+/t25-,28-,29-/m1/s1