Molecule ID: 71311469

IUPAC Name: (2R,3R,4R,5S)-(613C)hexane-1,2,3,4,5,6-hexol

Description: The molecule is a glucitol that is D-glucitol in which the carbon at position 1 is the (13)C isotope. It is a glucitol and a (13)C-modified compound.

SMILES: OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)[13CH2]O

SELFIES: [O][C][C@@H1][Branch1][C][O][C@@H1][Branch1][C][O][C@H1][Branch1][C][O][C@@H1][Branch1][C][O][13CH2][O]

InChI: InChI=1S/C6H14O6/c7-1-3(9)5(11)6(12)4(10)2-8/h3-12H,1-2H2/t3-,4+,5-,6-/m1/s1/i1+1/t3-,4+,5+,6+/m0

Molecular Properties:
- Polar Surface Area: 121.0 Ų
- LogP: -3.1