O1-methyl O5-(phenylmethyl) (2S,3S,4S)-2-acetyloxy-3-phenylmethoxy-4-(phenylmethoxycarbonylamino)pentanedioate

Systemtic Name: O1-methyl O5-(phenylmethyl) (2S,3S,4S)-2-acetyloxy-3-phenylmethoxy-4-(phenylmethoxycarbonylamino)pentanedioate Openeye Name: O1-benzyl O5-methyl (2S,3S,4S)-4-acetoxy-3-benzyloxy-2-(benzyloxycarbonylamino)pentanedioate CAS Name: (2S,3S,4S)-2-acetyloxy-3-phenylmethoxy-4-(phenylmethoxycarbonylamino)pentanedioic acid O1-methyl ester O5-(phenylmethyl) ester IUPAC Name: 5-O-benzyl 1-O-methyl (2S,3S,4S)-2-acetyloxy-3-phenylmethoxy-4-(phenylmethoxycarbonylamino)pentanedioate Traditional Name: (2S,3S,4S)-4-acetoxy-3-benzoxy-2-(benzyloxycarbonylamino)glutaric acid O1-benzyl ester O5-methyl ester Formula: C30H31NO9 MolecularWeight: 549.56844

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C(C(C(=O)OCC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2)OCC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC(=O)O[C@@H]([C@H]([C@@H](C(=O)OCC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2)OCC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C30H31NO9/c1-21(32)40-27(29(34)36-2)26(37-18-22-12-6-3-7-13-22)25(28(33)38-19-23-14-8-4-9-15-23)31-30(35)39-20-24-16-10-5-11-17-24/h3-17,25-27H,18-20H2,1-2H3,(H,31,35)/t25-,26-,27-/m0/s1