methyl (E,4S,5S,6R)-5-acetamido-2-methoxy-6,7-bis(oxidanyl)-4-phenylmethoxy-hept-2-enoate

Systemtic Name: methyl (E,4S,5S,6R)-5-acetamido-2-methoxy-6,7-bis(oxidanyl)-4-phenylmethoxy-hept-2-enoate Openeye Name: methyl (E,4S,5S,6R)-5-acetamido-4-benzyloxy-6,7-dihydroxy-2-methoxy-hept-2-enoate CAS Name: (E,4S,5S,6R)-5-acetamido-6,7-dihydroxy-2-methoxy-4-phenylmethoxy-2-heptenoic acid methyl ester IUPAC Name: methyl (E,4S,5S,6R)-5-acetamido-6,7-dihydroxy-2-methoxy-4-phenylmethoxyhept-2-enoate Traditional Name: (E,4S,5S,6R)-5-acetamido-4-benzoxy-6,7-dihydroxy-2-methoxy-hept-2-enoic acid methyl ester Formula: C18H25NO7 MolecularWeight: 367.3936

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(C(CO)O)C(C=C(C(=O)OC)OC)OCC1=CC=CC=C1

Isomeric SMILES

CC(=O)N[C@@H]([C@H](CO)O)[C@H](/C=C(\C(=O)OC)/OC)OCC1=CC=CC=C1

InChI

InChI=1S/C18H25NO7/c1-12(21)19-17(14(22)10-20)15(9-16(24-2)18(23)25-3)26-11-13-7-5-4-6-8-13/h4-9,14-15,17,20,22H,10-11H2,1-3H3,(H,19,21)/b16-9+/t14-,15-,17-/m0/s1