Molecule ID: 71627238

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

Description: The molecule is a branched pentasaccharide consisting of alpha-L-rhamnose, beta-D-glucose and two alpha-D-glucose residues in (1->3), (1->4) and (1->2) sequence, to the non-reducing-end glucose residue of which is also linked (1->3) an alpha-L-rhamnose residue.

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]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)[C@@H](O)[C@@H](O[C@@H]4[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]4O)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][#Branch1][C][O][C@@H1][C@@H1][Branch1][C][O][C@H1][Branch2][Branch1][=N][O][C@H1][C@H1][Branch2][Ring1][Ring2][O][C@@H1][O][C@@H1][Branch1][C][C][C@H1][Branch1][C][O][C@@H1][Branch1][C][O][C@H1][Ring1][=Branch2][O][C@@H1][Branch1][C][O][C@@H1][Branch2][Ring1][Branch1][O][C@@H1][C@@H1][Branch1][C][O][C@H1][Branch1][C][O][C@@H1][Branch1][Ring1][C][O][O][C@@H1][Ring1][#Branch2][O][O][C@@H1][Ring2][Ring1][=C][C][O][O][C@H1][Branch1][Ring1][C][O][C@H1][Ring2][Ring2][#Branch2][O][C@H1][Branch1][C][O][C@H1][Branch1][C][O][C@H1][Ring2][Branch1][Ring2][O]

InChI: InChI=1S/C30H52O24/c1-6-11(34)15(38)18(41)27(46-6)52-23-14(37)9(4-32)49-29(20(23)43)51-22-10(5-33)50-30(54-25-17(40)13(36)8(3-31)48-26(25)45)21(44)24(22)53-28-19(42)16(39)12(35)7(2)47-28/h6-45H,3-5H2,1-2H3/t6-,7-,8+,9+,10+,11-,12-,13+,14+,15+,16+,17-,18+,19+,20+,21+,22+,23-,24+,25+,26-,27-,28-,29-,30+/m0/s1

Molecular Properties:
- Polar Surface Area: 387.0 Ų
- LogP: -8.5