Glycoside
GD080867
Name:
NoneFormula:
C19H22O7N4Smiles:
CCOC(=O)c1c2c(N[C@H]3[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)ncnc2n2ccccc12Aglycone:
CCOC(=O)c1c2c(N)ncnc2n2ccccc12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.42 |
| AlogP: | -0.73 | Num_rotatable_bonds: | 5 |
| MolWt: | 418.41 | Num_heavy_atoms: | 30 |
| TPSA: | 158.67 | NumAromaticRings: | 3 |
Unique Aglycone
AD36510
Formula: C13H12O2N4
Smiles:
CCOC(=O)c1c2c(N)ncnc2n2ccccc12| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.15 |
| AlogP: | 1.64 | Num_rotatable_bonds: | 2 |
| MolWt: | 256.27 | Num_heavy_atoms: | 19 |
| TPSA: | 82.51 | NumAromaticRings: | 3 |
