Glycoside
GD049561
Name:
NoneFormula:
C14H20O6N2Smiles:
Cc1ccnc(CC(=O)N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)c1Aglycone:
Cc1ccnc(CC(N)=O)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.57 |
| AlogP: | -2.15 | Num_rotatable_bonds: | 4 |
| MolWt: | 312.32 | Num_heavy_atoms: | 22 |
| TPSA: | 132.14 | NumAromaticRings: | 1 |
Unique Aglycone
AD26241
Formula: C8H10ON2
Smiles:
Cc1ccnc(CC(N)=O)c1| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 0.42 | Num_rotatable_bonds: | 2 |
| MolWt: | 150.18 | Num_heavy_atoms: | 11 |
| TPSA: | 55.98 | NumAromaticRings: | 1 |
