Glycoside
GD019509
Name:
NoneFormula:
C20H25O4N7Smiles:
OC[C@@H]1OC(n2cnc3c(NN4CCCC4)nc(Nc4ccccc4)nc32)[C@H](O)[C@H]1OAglycone:
C1=Nc2c(nc(Nc3ccccc3)nc2NN2CCCC2)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.45 |
| AlogP: | 0.6 | Num_rotatable_bonds: | 6 |
| MolWt: | 427.47 | Num_heavy_atoms: | 31 |
| TPSA: | 140.82 | NumAromaticRings: | 3 |
Unique Aglycone
AD13615
Formula: C15H16N7
Smiles:
C1=Nc2c(nc(Nc3ccccc3)nc2NN2CCCC2)[N]1| HBA: | 7 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.27 |
| AlogP: | 2.55 | Num_rotatable_bonds: | 4 |
| MolWt: | 294.34 | Num_heavy_atoms: | 22 |
| TPSA: | 79.54 | NumAromaticRings: | 2 |
