(2R)-2-azanyl-3-[2,3-bis(oxidanyl)-4-phenylmethoxy-6-phenylmethoxycarbonyl-phenyl]sulfanyl-propanoic acid

Systemtic Name: (2R)-2-azanyl-3-[2,3-bis(oxidanyl)-4-phenylmethoxy-6-phenylmethoxycarbonyl-phenyl]sulfanyl-propanoic acid Openeye Name: (2R)-2-amino-3-(4-benzyloxy-6-benzyloxycarbonyl-2,3-dihydroxy-phenyl)sulfanyl-propanoic acid CAS Name: (2R)-2-amino-3-[(2,3-dihydroxy-4-phenylmethoxy-6-phenylmethoxycarbonylphenyl)thio]propanoic acid IUPAC Name: (2R)-2-amino-3-(2,3-dihydroxy-4-phenylmethoxy-6-phenylmethoxycarbonylphenyl)sulfanylpropanoic acid Traditional Name: (2R)-2-amino-3-[(4-benzoxy-6-carbobenzoxy-2,3-dihydroxy-phenyl)thio]propionic acid Formula: C24H23NO7S MolecularWeight: 469.50692

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C(=C(C(=C2)C(=O)OCC3=CC=CC=C3)SCC(C(=O)O)N)O)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C(=C(C(=C2)C(=O)OCC3=CC=CC=C3)SC[C@@H](C(=O)O)N)O)O

InChI

InChI=1S/C24H23NO7S/c25-18(23(28)29)14-33-22-17(24(30)32-13-16-9-5-2-6-10-16)11-19(20(26)21(22)27)31-12-15-7-3-1-4-8-15/h1-11,18,26-27H,12-14,25H2,(H,28,29)/t18-/m0/s1