Molecule ID: 71816585

IUPAC Name: (2S,3R,4R,5R,6S)-2-[(2S,3R,4S,5R,6R)-2-[(2R,3S,4R,5R,6S)-6-(5-aminopentoxy)-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-6-methyloxane-3,4,5-triol

Description: The molecule is a trisaccharide derivative consisting of an alpha-D-glucosyl residue glycosidically linked to a 5-aminopentyl group and which carries at O-4 an alpha-L-rhamnosyl-(1->3)-beta-D-glucosyl disaccharide unit. It is a trisaccharide derivative and a glycoside.

SMILES: C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](O[C@H]3[C@H](O)[C@@H](O)[C@@H](OCCCCCN)O[C@@H]3CO)O[C@H](CO)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O

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

InChI: InChI=1S/C23H43NO15/c1-9-12(27)14(29)16(31)22(35-9)39-20-13(28)10(7-25)36-23(18(20)33)38-19-11(8-26)37-21(17(32)15(19)30)34-6-4-2-3-5-24/h9-23,25-33H,2-8,24H2,1H3/t9-,10+,11+,12-,13+,14+,15+,16+,17+,18+,19+,20-,21-,22-,23-/m0/s1

Molecular Properties:
- Polar Surface Area: 264.0 Ų
- LogP: -5.2