Glycoside

GD082315
Name:
NoneFormula:
C18H20O9N2Smiles:
COC(=O)c1cc(-c2ccc(C(=O)N[C@H]3[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)cc2)on1Aglycone:
COC(=O)c1cc(-c2ccc(C(N)=O)cc2)on1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 11 | RingCount: | 3 |
HBD: | 5 | FractionCSP3: | 0.39 |
AlogP: | -1.34 | Num_rotatable_bonds: | 5 |
MolWt: | 408.36 | Num_heavy_atoms: | 29 |
TPSA: | 171.58 | NumAromaticRings: | 2 |
Unique Aglycone
AD36976
Formula: C12H10O4N2
Smiles:
COC(=O)c1cc(-c2ccc(C(N)=O)cc2)on1HBA: | 6 | RingCount: | 2 |
HBD: | 2 | FractionCSP3: | 0.08 |
AlogP: | 1.23 | Num_rotatable_bonds: | 3 |
MolWt: | 246.22 | Num_heavy_atoms: | 18 |
TPSA: | 95.42 | NumAromaticRings: | 2 |