Glycoside
GD067972
Name:
NoneFormula:
C17H19O5N5Smiles:
O=c1[nH]cnc2c1nc(NCc1ccccc1)n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1OAglycone:
O=c1[nH]cnc2c1N=C(NCc1ccccc1)[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.35 |
| AlogP: | -0.66 | Num_rotatable_bonds: | 5 |
| MolWt: | 373.37 | Num_heavy_atoms: | 27 |
| TPSA: | 145.52 | NumAromaticRings: | 3 |
Unique Aglycone
AD32215
Formula: C12H10ON5
Smiles:
O=c1[nH]cnc2c1N=C(NCc1ccccc1)[N]2| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.08 |
| AlogP: | 0.8 | Num_rotatable_bonds: | 2 |
| MolWt: | 240.25 | Num_heavy_atoms: | 18 |
| TPSA: | 84.24 | NumAromaticRings: | 2 |
