O6,O7-bis[(2S)-1-ethoxy-1-oxidanylidene-propan-2-yl] O8-methyl (7S,8R)-5-(3,4,5-trimethoxyphenyl)-7,8-dihydrobenzo[f][1,3]benzodioxole-6,7,8-tricarboxylate

Systemtic Name: O6,O7-bis[(2S)-1-ethoxy-1-oxidanylidene-propan-2-yl] O8-methyl (7S,8R)-5-(3,4,5-trimethoxyphenyl)-7,8-dihydrobenzo[f][1,3]benzodioxole-6,7,8-tricarboxylate Openeye Name: O6,O7-bis[(1S)-2-ethoxy-1-methyl-2-oxo-ethyl] O8-methyl (7S,8R)-5-(3,4,5-trimethoxyphenyl)-7,8-dihydrobenzo[f][1,3]benzodioxole-6,7,8-tricarboxylate CAS Name: (7S,8R)-5-(3,4,5-trimethoxyphenyl)-7,8-dihydrobenzo[f][1,3]benzodioxole-6,7,8-tricarboxylic acid O6,O7-bis[(2S)-1-ethoxy-1-oxopropan-2-yl] ester O8-methyl ester IUPAC Name: 6-O,7-O-bis[(2S)-1-ethoxy-1-oxopropan-2-yl] 8-O-methyl (7S,8R)-5-(3,4,5-trimethoxyphenyl)-7,8-dihydrobenzo[f][1,3]benzodioxole-6,7,8-tricarboxylate Traditional Name: (7S,8R)-5-(3,4,5-trimethoxyphenyl)-7,8-dihydrobenzo[f][1,3]benzodioxole-6,7,8-tricarboxylic acid O6,O7-bis[(1S)-2-ethoxy-2-keto-1-methyl-ethyl] ester O8-methyl ester Formula: C34H38O15 MolecularWeight: 686.65652

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)OC(=O)C1C(C2=CC3=C(C=C2C(=C1C(=O)OC(C)C(=O)OCC)C4=CC(=C(C(=C4)OC)OC)OC)OCO3)C(=O)OC

Isomeric SMILES

CCOC(=O)[C@H](C)OC(=O)[C@H]1[C@H](C2=CC3=C(C=C2C(=C1C(=O)O[C@@H](C)C(=O)OCC)C4=CC(=C(C(=C4)OC)OC)OC)OCO3)C(=O)OC

InChI

InChI=1S/C34H38O15/c1-9-44-30(35)16(3)48-33(38)27-25(18-11-23(40-5)29(42-7)24(12-18)41-6)19-13-21-22(47-15-46-21)14-20(19)26(32(37)43-8)28(27)34(39)49-17(4)31(36)45-10-2/h11-14,16-17,26,28H,9-10,15H2,1-8H3/t16-,17-,26-,28-/m0/s1