Molecule ID: 122391273

IUPAC Name: (2S,3S,4S,5R,6R)-6-(2-aminoethoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

Description: The molecule is a beta-D-glucoside that is the 2-aminoethyl glycoside of the monosaccharide derivative beta-D-glucopyranuronic acid. It is a beta-D-glucoside and a monosaccharide derivative.

SMILES: NCCO[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]1O

SELFIES: [N][C][C][O][C@@H1][O][C@H1][Branch1][=Branch1][C][=Branch1][C][=O][O][C@@H1][Branch1][C][O][C@H1][Branch1][C][O][C@H1][Ring1][O][O]

InChI: InChI=1S/C8H15NO7/c9-1-2-15-8-5(12)3(10)4(11)6(16-8)7(13)14/h3-6,8,10-12H,1-2,9H2,(H,13,14)/t3-,4-,5+,6-,8+/m0/s1

Molecular Properties:
- Polar Surface Area: 143.0 Ų
- LogP: -5.0