Molecule ID: 129011052

IUPAC Name: methyl 6-[(2S,3S,4S,5R,6R)-5-formamido-3-hydroxy-6-methyl-4-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxyhexanoate

Description: The molecule is a glycoside that consists of an alpha-D-mannose residue linked (1->3) to an N-formyl-alpha-D-perosamine residue which in turn is linked glycosidically to a 5-(methoxycarbonyl)pentyl group. It is a methyl ester, a glycoside and a disaccharide derivative.

SMILES: COC(=O)CCCCCO[C@H]1O[C@H](C)[C@@H](N=CO)[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)[C@@H]1O

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

InChI: InChI=1S/C20H35NO12/c1-10-13(21-9-23)18(33-20-16(27)15(26)14(25)11(8-22)32-20)17(28)19(31-10)30-7-5-3-4-6-12(24)29-2/h9-11,13-20,22,25-28H,3-8H2,1-2H3,(H,21,23)/t10-,11-,13-,14-,15+,16+,17+,18+,19+,20-/m1/s1

Molecular Properties:
- Polar Surface Area: 194.0 Ų
- LogP: -2.2