Glycoside
GD063968
Name:
NoneFormula:
C16H22O7N2Smiles:
COc1cccnc1C1(C(=O)N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)CC1Aglycone:
COc1cccnc1C1(C(N)=O)CC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.62 |
| AlogP: | -1.96 | Num_rotatable_bonds: | 5 |
| MolWt: | 354.36 | Num_heavy_atoms: | 25 |
| TPSA: | 141.37 | NumAromaticRings: | 1 |
Unique Aglycone
AD30775
Formula: C10H12O2N2
Smiles:
COc1cccnc1C1(C(N)=O)CC1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.4 |
| AlogP: | 0.61 | Num_rotatable_bonds: | 3 |
| MolWt: | 192.22 | Num_heavy_atoms: | 14 |
| TPSA: | 65.21 | NumAromaticRings: | 1 |
