Glycoside
GD054046
Name:
NoneFormula:
C14H20O7N2Smiles:
CCOc1cncc(C(=O)N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)c1Aglycone:
CCOc1cncc(C(N)=O)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.57 |
| AlogP: | -1.99 | Num_rotatable_bonds: | 5 |
| MolWt: | 328.32 | Num_heavy_atoms: | 23 |
| TPSA: | 141.37 | NumAromaticRings: | 1 |
Unique Aglycone
AD27547
Formula: C8H10O2N2
Smiles:
CCOc1cncc(C(N)=O)c1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 0.58 | Num_rotatable_bonds: | 3 |
| MolWt: | 166.18 | Num_heavy_atoms: | 12 |
| TPSA: | 65.21 | NumAromaticRings: | 1 |
