5-[2-acetyloxy-4,5,6-tris(oxidanyl)-1-oxidanylidene-hexan-3-yl]oxy-2-azanyl-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[2-acetyloxy-4,5,6-tris(oxidanyl)-1-oxidanylidene-hexan-3-yl]oxy-2-azanyl-5-oxidanylidene-pentanoic acid Openeye Name: 5-[1-(1-acetoxy-2-oxo-ethyl)-2,3,4-trihydroxy-butoxy]-2-amino-5-oxo-pentanoic acid CAS Name: 5-(2-acetyloxy-4,5,6-trihydroxy-1-oxohexan-3-yl)oxy-2-amino-5-oxopentanoic acid IUPAC Name: 5-(2-acetyloxy-4,5,6-trihydroxy-1-oxohexan-3-yl)oxy-2-amino-5-oxopentanoic acid Traditional Name: 5-[1-(1-acetoxy-2-keto-ethyl)-2,3,4-trihydroxy-butoxy]-2-amino-5-keto-valeric acid Formula: C13H21NO10 MolecularWeight: 351.30654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C=O)C(C(C(CO)O)O)OC(=O)CCC(C(=O)O)N

Isomeric SMILES

CC(=O)OC(C=O)C(C(C(CO)O)O)OC(=O)CCC(C(=O)O)N

InChI

InChI=1S/C13H21NO10/c1-6(17)23-9(5-16)12(11(20)8(18)4-15)24-10(19)3-2-7(14)13(21)22/h5,7-9,11-12,15,18,20H,2-4,14H2,1H3,(H,21,22)