Glycoside

GD040180
Name:
2-deoxy-2-(trimethylammonio)-beta-d-glucopyranosyl-(1->4)-2-(acetylamino)-2-deoxy-beta-d-glucopyranosyl-(1->4)-2-(acety lamino)-2-deoxy-beta-d-glucopyranosyl-(1->4)-2-(acetylamino)-2-deoxy-beta-d-glucopyranoseFormula:
C33H59O20N4Smiles:
CC(=O)N[C@@H]1[C@@H](O[C@H]2[C@@H](CO)O[C@@H](O)[C@H](NC(C)=O)[C@H]2O)O[C@H](CO)[C@H](O[C@H]2O[C@H](CO)[C@H](O[C@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@@H]3[N+](C)(C)C)[C@H](O)[C@@H]2NC(C)=O)[C@@H]1OAglycone:
[empty]Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(OC2OC(CO)C(OC3OC(CO)C(OC4OC(CO)C(O)C(O)C4[N+](C)(C)C)C(O)C3NC(C)=O)C(O)C2NC(C)=O)C1OOther Identifiers
Properties
HBA: | 24 | RingCount: | 4 |
HBD: | 13 | FractionCSP3: | 0.91 |
AlogP: | -8.6 | Num_rotatable_bonds: | 14 |
MolWt: | 831.84 | Num_heavy_atoms: | 57 |
TPSA: | 354.21 | NumAromaticRings: | 0 |
Unique Aglycone
Sugarmoiety

SD03558
CC(=O)NC1C(O)OC(CO)C(OC2OC(CO)C(OC3OC(CO)C(OC4OC(CO)C(O)C(O)C4[N+](C)(C)C)C(O)C3NC(C)=O)C(O)C2NC(C)=O)C1O