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2-acetamido-3,4,5,6-tetrakis(oxidanyl)hexanoic acid; ethanoic acid

2-acetamido-3,4,5,6-tetrakis(oxidanyl)hexanoic acid; ethanoic acid

Systemtic Name:2-acetamido-3,4,5,6-tetrakis(oxidanyl)hexanoic acid; ethanoic acid
Openeye Name:2-acetamido-3,4,5,6-tetrahydroxy-hexanoic acid; acetic acid
CAS Name:2-acetamido-3,4,5,6-tetrahydroxyhexanoic acid; acetic acid
IUPAC Name:2-acetamido-3,4,5,6-tetrahydroxyhexanoic acid; acetic acid
Traditional Name:2-acetamido-3,4,5,6-tetrahydroxy-hexanoic acid; acetic acid
Formula: C14H27NO13
MolecularWeight: 417.36308
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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(C(C(C(CO)O)O)O)C(=O)O.CC(=O)O.CC(=O)O.CC(=O)O


Isomeric SMILES

CC(=O)NC(C(C(C(CO)O)O)O)C(=O)O.CC(=O)O.CC(=O)O.CC(=O)O


InChI

InChI=1S/C8H15NO7.3C2H4O2/c1-3(11)9-5(8(15)16)7(14)6(13)4(12)2-10;3*1-2(3)4/h4-7,10,12-14H,2H2,1H3,(H,9,11)(H,15,16);3*1H3,(H,3,4)


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