methyl (E,6S,7R,8S)-8-oxidanyl-6,7,9-tris(phenylmethoxy)non-4-enoate

Systemtic Name: methyl (E,6S,7R,8S)-8-oxidanyl-6,7,9-tris(phenylmethoxy)non-4-enoate Openeye Name: methyl (E,6S,7R,8S)-6,7,9-tribenzyloxy-8-hydroxy-non-4-enoate CAS Name: (E,6S,7R,8S)-8-hydroxy-6,7,9-tris(phenylmethoxy)-4-nonenoic acid methyl ester IUPAC Name: methyl (E,6S,7R,8S)-8-hydroxy-6,7,9-tris(phenylmethoxy)non-4-enoate Traditional Name: (E,6S,7R,8S)-6,7,9-tribenzoxy-8-hydroxy-non-4-enoic acid methyl ester Formula: C31H36O6 MolecularWeight: 504.61394

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC=CC(C(C(COCC1=CC=CC=C1)O)OCC2=CC=CC=C2)OCC3=CC=CC=C3

Isomeric SMILES

COC(=O)CC/C=C/[C@@H]([C@@H]([C@H](COCC1=CC=CC=C1)O)OCC2=CC=CC=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C31H36O6/c1-34-30(33)20-12-11-19-29(36-22-26-15-7-3-8-16-26)31(37-23-27-17-9-4-10-18-27)28(32)24-35-21-25-13-5-2-6-14-25/h2-11,13-19,28-29,31-32H,12,20-24H2,1H3/b19-11+/t28-,29-,31+/m0/s1