methyl (Z,5R,6S,7R)-7-acetyloxy-5,6-bis(oxidanyl)-7-phenyl-hept-2-enoate

Systemtic Name: methyl (Z,5R,6S,7R)-7-acetyloxy-5,6-bis(oxidanyl)-7-phenyl-hept-2-enoate Openeye Name: methyl (Z,5R,6S,7R)-7-acetoxy-5,6-dihydroxy-7-phenyl-hept-2-enoate CAS Name: (Z,5R,6S,7R)-7-acetyloxy-5,6-dihydroxy-7-phenyl-2-heptenoic acid methyl ester IUPAC Name: methyl (Z,5R,6S,7R)-7-acetyloxy-5,6-dihydroxy-7-phenylhept-2-enoate Traditional Name: (Z,5R,6S,7R)-7-acetoxy-5,6-dihydroxy-7-phenyl-hept-2-enoic acid methyl ester Formula: C16H20O6 MolecularWeight: 308.3264

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C1=CC=CC=C1)C(C(CC=CC(=O)OC)O)O

Isomeric SMILES

CC(=O)O[C@H](C1=CC=CC=C1)[C@H]([C@@H](C/C=C\C(=O)OC)O)O

InChI

InChI=1S/C16H20O6/c1-11(17)22-16(12-7-4-3-5-8-12)15(20)13(18)9-6-10-14(19)21-2/h3-8,10,13,15-16,18,20H,9H2,1-2H3/b10-6-/t13-,15+,16-/m1/s1