Glycoside
...
GD026095

Name:
None

Formula:
C32H54O22N2

Smiles:
CC(=O)N[C@@H]1[C@H](O)C[C@](O[C@@H]2[C@H](O)[C@H](O[C@@H]3[C@H](CO)O[C@H](O)[C@H](NC(C)=O)[C@H]3O[C@@H]3O[C@H](C)[C@H](O)[C@H](O)[C@H]3O)O[C@H](CO)[C@H]2O)(C(=O)O)C[C@H]1[C@H](O)[C@H](O)CO

Aglycone:
CC(=O)NC1C(O)CC(O)(C(=O)O)CC1C(O)C(O)CO

Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C1OC1OC(C)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 24 RingCount: 4
HBD: 15 FractionCSP3: 0.91
AlogP: -8.56 Num_rotatable_bonds: 14
MolWt: 818.78 Num_heavy_atoms: 56
TPSA: 393.64 NumAromaticRings: 0

Unique Aglycone
AD17228
Formula: C12H21O8N

Smiles:
CC(=O)NC1C(O)CC(O)(C(=O)O)CC1C(O)C(O)CO
HBA: 9 RingCount: 1
HBD: 7 FractionCSP3: 0.83
AlogP: -3.21 Num_rotatable_bonds: 5
MolWt: 307.3 Num_heavy_atoms: 21
TPSA: 167.55 NumAromaticRings: 0

Sugarmoiety
SD00319

CC(=O)NC1C(O)OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C1OC1OC(C)C(O)C(O)C1O