Glycoside
GD004549
Name:
NoneFormula:
C20H28O4N8Smiles:
CNc1nc(-n2cc(CC3CCCCC3)nn2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
CNc1nc(-n2cc(CC3CCCCC3)nn2)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.65 |
| AlogP: | 0.18 | Num_rotatable_bonds: | 6 |
| MolWt: | 444.5 | Num_heavy_atoms: | 32 |
| TPSA: | 156.26 | NumAromaticRings: | 3 |
Unique Aglycone
AD03957
Formula: C15H19N8
Smiles:
CNc1nc(-n2cc(CC3CCCCC3)nn2)nc2c1N=C[N]2| HBA: | 8 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.53 |
| AlogP: | 2.13 | Num_rotatable_bonds: | 4 |
| MolWt: | 311.37 | Num_heavy_atoms: | 23 |
| TPSA: | 94.98 | NumAromaticRings: | 2 |
