Molecule ID: 118796865

IUPAC Name: [(6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl] phosphate

Description: The molecule is dianion of N-acetyl-D-hexosamine 1-phosphate arising from deprotonation of both phosphate OH groups. It is a conjugate base of a N-acetyl-D-hexosamine 1-phosphate.

SMILES: CC([O-])=NC1C(OP(=O)([O-])O)O[C@H](CO)C(O)C1O

SELFIES: [C][C][Branch1][C][O-1][=N][C][C][Branch1][#Branch2][O][P][=Branch1][C][=O][Branch1][C][O-1][O][O][C@H1][Branch1][Ring1][C][O][C][Branch1][C][O][C][Ring1][=C][O]

InChI: InChI=1S/C8H16NO9P/c1-3(11)9-5-7(13)6(12)4(2-10)17-8(5)18-19(14,15)16/h4-8,10,12-13H,2H2,1H3,(H,9,11)(H2,14,15,16)/p-2/t4-,5?,6?,7?,8?/m1/s1

Molecular Properties:
- Polar Surface Area: 171.0 Ų
- LogP: -3.8