Glycoside
GD089201
Name:
NoneFormula:
C20H24O5N6Smiles:
Nc1nc2c(nc(N3CC[C@H](c4ccccc4)C3)n2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)[nH]1Aglycone:
Nc1nc2c(c(=O)[nH]1)N=C(N1CCC(c3ccccc3)C1)[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.45 |
| AlogP: | -0.69 | Num_rotatable_bonds: | 4 |
| MolWt: | 428.45 | Num_heavy_atoms: | 31 |
| TPSA: | 162.75 | NumAromaticRings: | 3 |
Unique Aglycone
AD38937
Formula: C15H15ON6
Smiles:
Nc1nc2c(c(=O)[nH]1)N=C(N1CCC(c3ccccc3)C1)[N]2| HBA: | 7 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.27 |
| AlogP: | 1.08 | Num_rotatable_bonds: | 1 |
| MolWt: | 295.33 | Num_heavy_atoms: | 22 |
| TPSA: | 101.47 | NumAromaticRings: | 2 |
