Glycoside
GD036637
Name:
NoneFormula:
C15H18O4N6Smiles:
C[C@]1(O)[C@H](c2cc(-c3ncc[nH]3)c3c(N)ncnn23)O[C@H](CO)[C@H]1OAglycone:
Nc1ncnn2ccc(-c3ncc[nH]3)c12Sugarmoiety:
CC1(O)C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.4 |
| AlogP: | -0.75 | Num_rotatable_bonds: | 3 |
| MolWt: | 346.35 | Num_heavy_atoms: | 25 |
| TPSA: | 154.81 | NumAromaticRings: | 3 |
Unique Aglycone
AD23100
Formula: C9H8N6
Smiles:
Nc1ncnn2ccc(-c3ncc[nH]3)c12| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 0.7 | Num_rotatable_bonds: | 1 |
| MolWt: | 200.21 | Num_heavy_atoms: | 15 |
| TPSA: | 84.89 | NumAromaticRings: | 3 |
