Molecule ID: 134160306

IUPAC Name: (3S,4S,5S,6R)-6-[[(2S,3S,4S,5S,6R)-6-[[(2S,3S,4S,5S,6R)-3-[(2R,3S,4S,5R)-5-[[(2S,3S,4S,5R)-5-[[(2S,3S,4S,5R)-5-[[(2S,3S,4S,5R)-5-[[(2S,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4-dihydroxyoxolan-2-yl]oxymethyl]-3,4-dihydroxyoxolan-2-yl]oxymethyl]-3,4-dihydroxyoxolan-2-yl]oxymethyl]-3,4-dihydroxyoxolan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxane-2,3,4,5-tetrol

Description: The molecule is a linear octasaccharide consisting of a chain of five D-arabinofuranose and three D-mannopyranose residues linked sequentially alpha(1->5), alpha(1->5), alpha(1->5), alpha(1->5), alpha(1->2), alpha(1->6) and alpha(1->6).

SMILES: OC[C@H]1O[C@H](OC[C@H]2O[C@H](OC[C@H]3O[C@H](OC[C@H]4O[C@H](OC[C@H]5O[C@H](O[C@@H]6[C@@H](OC[C@H]7O[C@H](OC[C@H]8OC(O)[C@@H](O)[C@@H](O)[C@@H]8O)[C@@H](O)[C@@H](O)[C@@H]7O)O[C@H](CO)[C@@H](O)[C@@H]6O)[C@@H](O)[C@@H]5O)[C@@H](O)[C@@H]4O)[C@@H](O)[C@@H]3O)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H]1O

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

InChI: InChI=1S/C43H72O36/c44-1-9-17(46)27(56)35(43(73-9)70-8-12-20(49)26(55)34(63)41(74-12)65-3-11-19(48)25(54)28(57)36(64)71-11)79-42-33(62)24(53)16(78-42)7-69-40-32(61)23(52)15(77-40)6-68-39-31(60)22(51)14(76-39)5-67-38-30(59)21(50)13(75-38)4-66-37-29(58)18(47)10(2-45)72-37/h9-64H,1-8H2/t9-,10-,11-,12-,13-,14-,15-,16-,17-,18-,19-,20-,21-,22-,23-,24-,25+,26+,27+,28+,29+,30+,31+,32+,33+,34+,35+,36?,37+,38+,39+,40+,41+,42-,43+/m1/s1

Molecular Properties:
- Polar Surface Area: 563.0 Ų
- LogP: -14.0