Glycoside
GD021435
Name:
NoneFormula:
C26H26O7N6Smiles:
O=C(O)Cc1ccc(NC(=O)Cc2ccc(Nc3ncnc4c3ncn4C3O[C@H](CO)[C@H](O)[C@H]3O)cc2)cc1Aglycone:
O=C(O)Cc1ccc(NC(=O)Cc2ccc(Nc3ncnc4c3N=C[N]4)cc2)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.27 |
| AlogP: | 0.99 | Num_rotatable_bonds: | 9 |
| MolWt: | 534.53 | Num_heavy_atoms: | 39 |
| TPSA: | 191.95 | NumAromaticRings: | 4 |
Unique Aglycone
AD14663
Formula: C21H17O3N6
Smiles:
O=C(O)Cc1ccc(NC(=O)Cc2ccc(Nc3ncnc4c3N=C[N]4)cc2)cc1| HBA: | 9 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.1 |
| AlogP: | 2.94 | Num_rotatable_bonds: | 7 |
| MolWt: | 401.41 | Num_heavy_atoms: | 30 |
| TPSA: | 130.67 | NumAromaticRings: | 3 |
