methyl (5R,6R,7S,8S)-7-methanoyl-8-oxidanyl-5-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxole-6-carboxylate

Systemtic Name: methyl (5R,6R,7S,8S)-7-methanoyl-8-oxidanyl-5-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxole-6-carboxylate Openeye Name: methyl (5R,6R,7S,8S)-7-formyl-8-hydroxy-5-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxole-6-carboxylate CAS Name: (5R,6R,7S,8S)-7-formyl-8-hydroxy-5-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxole-6-carboxylic acid methyl ester IUPAC Name: methyl (5R,6R,7S,8S)-7-formyl-8-hydroxy-5-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxole-6-carboxylate Traditional Name: (5R,6R,7S,8S)-7-formyl-8-hydroxy-5-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxole-6-carboxylic acid methyl ester Formula: C23H24O9 MolecularWeight: 444.43126

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2C(C(C(C3=CC4=C(C=C23)OCO4)O)C=O)C(=O)OC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)[C@H]2[C@H]([C@@H]([C@@H](C3=CC4=C(C=C23)OCO4)O)C=O)C(=O)OC

InChI

InChI=1S/C23H24O9/c1-27-17-5-11(6-18(28-2)22(17)29-3)19-12-7-15-16(32-10-31-15)8-13(12)21(25)14(9-24)20(19)23(26)30-4/h5-9,14,19-21,25H,10H2,1-4H3/t14-,19+,20-,21+/m0/s1