[3,4,5,6-tetrakis(oxidanyl)-1-oxidanylidene-hexan-2-yl] 2-azanyl-3-(4-hydroxyphenyl)propanoate

Systemtic Name: [3,4,5,6-tetrakis(oxidanyl)-1-oxidanylidene-hexan-2-yl] 2-azanyl-3-(4-hydroxyphenyl)propanoate Openeye Name: (1-formyl-2,3,4,5-tetrahydroxy-pentyl) 2-amino-3-(4-hydroxyphenyl)propanoate CAS Name: 2-amino-3-(4-hydroxyphenyl)propanoic acid (3,4,5,6-tetrahydroxy-1-oxohexan-2-yl) ester IUPAC Name: (3,4,5,6-tetrahydroxy-1-oxohexan-2-yl) 2-amino-3-(4-hydroxyphenyl)propanoate Traditional Name: 2-amino-3-(4-hydroxyphenyl)propionic acid (1-formyl-2,3,4,5-tetrahydroxy-pentyl) ester Formula: C15H21NO8 MolecularWeight: 343.32914

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)OC(C=O)C(C(C(CO)O)O)O)N)O

Isomeric SMILES

C1=CC(=CC=C1CC(C(=O)OC(C=O)C(C(C(CO)O)O)O)N)O

InChI

InChI=1S/C15H21NO8/c16-10(5-8-1-3-9(19)4-2-8)15(23)24-12(7-18)14(22)13(21)11(20)6-17/h1-4,7,10-14,17,19-22H,5-6,16H2