Molecule ID: 129011049

IUPAC Name: methyl 6-[(2S,3S,4S,5R,6R)-5-formamido-4-[(2R,3S,4S,5R,6R)-5-formamido-3,4-dimethoxy-6-methyloxan-2-yl]oxy-3-hydroxy-6-methyloxan-2-yl]oxyhexanoate

Description: The molecule is a glycoside that consists of an N-formyl-2,3-di-O-methyl-alpha-D-perosamine residue linked (1->3) to an N-formyl-alpha-D-perosamine residue which is linked glycosidically to a 5-(methoxycarbonyl)pentyl group. It is a disaccharide derivative, a glycoside and a methyl ester.

SMILES: COC(=O)CCCCCO[C@H]1O[C@H](C)[C@@H](N=CO)[C@H](O[C@H]2O[C@H](C)[C@@H](N=CO)[C@H](OC)[C@@H]2OC)[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][Branch2][O][C@H1][O][C@H1][Branch1][C][C][C@@H1][Branch1][Ring2][N][=C][O][C@H1][Branch1][Ring1][O][C][C@@H1][Ring1][N][O][C][C@@H1][Ring2][Ring1][=Branch2][O]

InChI: InChI=1S/C23H40N2O11/c1-13-16(24-11-26)19(18(29)22(34-13)33-10-8-6-7-9-15(28)30-3)36-23-21(32-5)20(31-4)17(25-12-27)14(2)35-23/h11-14,16-23,29H,6-10H2,1-5H3,(H,24,26)(H,25,27)/t13-,14-,16-,17-,18+,19+,20+,21+,22+,23-/m1/s1

Molecular Properties:
- Polar Surface Area: 160.0 Ų
- LogP: -0.7