Glycoside
GD076899
Name:
NoneFormula:
C18H20O6N4Smiles:
COc1ccccc1-n1c(C)nc2c(cnn2[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)c1=OAglycone:
COc1ccccc1-n1c(C)nc2c(c1=O)C=N[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.39 |
| AlogP: | -0.49 | Num_rotatable_bonds: | 4 |
| MolWt: | 388.38 | Num_heavy_atoms: | 28 |
| TPSA: | 131.86 | NumAromaticRings: | 3 |
Unique Aglycone
AD35313
Formula: C13H11O2N4
Smiles:
COc1ccccc1-n1c(C)nc2c(c1=O)C=N[N]2| HBA: | 6 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.15 |
| AlogP: | 1.13 | Num_rotatable_bonds: | 2 |
| MolWt: | 255.26 | Num_heavy_atoms: | 19 |
| TPSA: | 70.58 | NumAromaticRings: | 2 |
