Glycoside

GD040408
Name:
methyl 2-(acetylamino)-2-deoxy-beta-d-glucopyranosyl-(1->2)-alpha-d-mannopyranosyl-(1->3)-[alpha-d-mannopyranosyl-(1->6)-6-thio -alpha-d-mannopyranosyl-(1->6)]-beta-d-mannopyranosideFormula:
C33H57O25NSSmiles:
CO[C@@H]1O[C@H](CO[C@H]2O[C@H](CS[C@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@@H]3O)[C@H](O)[C@H](O)[C@@H]2O)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2NC(C)=O)[C@@H]1OAglycone:
[empty]Sugarmoiety:
COC1OC(COC2OC(CSC3OC(CO)C(O)C(O)C3O)C(O)C(O)C2O)C(O)C(OC2OC(CO)C(O)C(O)C2OC2OC(CO)C(O)C(O)C2NC(C)=O)C1OOther Identifiers
Properties
HBA: | 26 | RingCount: | 5 |
HBD: | 16 | FractionCSP3: | 0.97 |
AlogP: | -10.41 | Num_rotatable_bonds: | 15 |
MolWt: | 899.87 | Num_heavy_atoms: | 60 |
TPSA: | 415.62 | NumAromaticRings: | 0 |
Unique Aglycone
Sugarmoiety

SD03590
COC1OC(COC2OC(CSC3OC(CO)C(O)C(O)C3O)C(O)C(O)C2O)C(O)C(OC2OC(CO)C(O)C(O)C2OC2OC(CO)C(O)C(O)C2NC(C)=O)C1O