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-mannopyranoside

Formula:
C33H57O25NS

Smiles:
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]1O

Aglycone:
[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)C1O

Other 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