5-acetamido-2-[[6-[5-azanyl-1,2,4-tris(oxidanyl)-6-oxidanylidene-hexan-3-yl]oxy-3,4,5-tris(oxidanyl)oxan-2-yl]methoxy]-4-oxidanyl-6-[1,2,3-tris(oxidanyl)propyl]oxane-2-carboxylic acid

Systemtic Name: 5-acetamido-2-[[6-[5-azanyl-1,2,4-tris(oxidanyl)-6-oxidanylidene-hexan-3-yl]oxy-3,4,5-tris(oxidanyl)oxan-2-yl]methoxy]-4-oxidanyl-6-[1,2,3-tris(oxidanyl)propyl]oxane-2-carboxylic acid Openeye Name: 5-acetamido-2-[[6-[3-amino-1-(1,2-dihydroxyethyl)-2-hydroxy-4-oxo-butoxy]-3,4,5-trihydroxy-tetrahydropyran-2-yl]methoxy]-4-hydroxy-6-(1,2,3-trihydroxypropyl)tetrahydropyran-2-carboxylic acid CAS Name: 5-acetamido-2-[[6-(5-amino-1,2,4-trihydroxy-6-oxohexan-3-yl)oxy-3,4,5-trihydroxy-2-oxanyl]methoxy]-4-hydroxy-6-(1,2,3-trihydroxypropyl)-2-oxanecarboxylic acid IUPAC Name: 5-acetamido-2-[[6-(5-amino-1,2,4-trihydroxy-6-oxohexan-3-yl)oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-4-hydroxy-6-(1,2,3-trihydroxypropyl)oxane-2-carboxylic acid Traditional Name: 5-acetamido-2-[[6-[3-amino-1-(1,2-dihydroxyethyl)-2-hydroxy-4-keto-butoxy]-3,4,5-trihydroxy-tetrahydropyran-2-yl]methoxy]-4-hydroxy-6-(1,2,3-trihydroxypropyl)tetrahydropyran-2-carboxylic acid Formula: C23H40N2O18 MolecularWeight: 632.5663

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(CC(OC1C(C(CO)O)O)(C(=O)O)OCC2C(C(C(C(O2)OC(C(CO)O)C(C(C=O)N)O)O)O)O)O

Isomeric SMILES

CC(=O)NC1C(CC(OC1C(C(CO)O)O)(C(=O)O)OCC2C(C(C(C(O2)OC(C(CO)O)C(C(C=O)N)O)O)O)O)O

InChI

InChI=1S/C23H40N2O18/c1-7(29)25-13-9(30)2-23(22(38)39,43-20(13)15(34)10(31)4-27)40-6-12-16(35)17(36)18(37)21(41-12)42-19(11(32)5-28)14(33)8(24)3-26/h3,8-21,27-28,30-37H,2,4-6,24H2,1H3,(H,25,29)(H,38,39)