Molecule ID: 145864714

IUPAC Name: (2R,3S,4S,5R,6R)-2-[(2R,3R,4R,5S,6S)-5,6-dihydroxy-2-(hydroxymethyl)-4-methoxyoxan-3-yl]oxy-6-(hydroxymethyl)-4-methoxyoxane-3,5-diol

Description: The molecule is a disaccharide derivative that is alpha-mannobiose in which the hydroxy group at position 3 of each mannose residue has been substituted by a methyl group. It derives from an alpha-mannobiose.

SMILES: CO[C@@H]1[C@H](O)[C@@H](O[C@H]2[C@H](OC)[C@H](O)[C@@H](O)O[C@@H]2CO)O[C@H](CO)[C@H]1O

SELFIES: [C][O][C@@H1][C@H1][Branch1][C][O][C@@H1][Branch2][Ring1][=Branch1][O][C@H1][C@H1][Branch1][Ring1][O][C][C@H1][Branch1][C][O][C@@H1][Branch1][C][O][O][C@@H1][Ring1][#Branch2][C][O][O][C@H1][Branch1][Ring1][C][O][C@H1][Ring2][Ring1][=Branch1][O]

InChI: InChI=1S/C14H26O11/c1-21-11-7(17)5(3-15)24-14(9(11)19)25-10-6(4-16)23-13(20)8(18)12(10)22-2/h5-20H,3-4H2,1-2H3/t5-,6-,7-,8+,9+,10-,11+,12-,13+,14-/m1/s1

Molecular Properties:
- Polar Surface Area: 168.0 Ų
- LogP: -3.7