Glycoside
GD030698
Name:
NoneFormula:
C27H28O7N6Smiles:
COC(=O)Cc1ccc(NC(=O)Cc2ccc(Nc3ncnc4c3ncn4C3O[C@H](CO)[C@H](O)[C@H]3O)cc2)cc1Aglycone:
COC(=O)Cc1ccc(NC(=O)Cc2ccc(Nc3ncnc4c3N=C[N]4)cc2)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.3 |
| AlogP: | 1.08 | Num_rotatable_bonds: | 9 |
| MolWt: | 548.56 | Num_heavy_atoms: | 40 |
| TPSA: | 180.95 | NumAromaticRings: | 4 |
Unique Aglycone
AD19852
Formula: C22H19O3N6
Smiles:
COC(=O)Cc1ccc(NC(=O)Cc2ccc(Nc3ncnc4c3N=C[N]4)cc2)cc1| HBA: | 9 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 3.03 | Num_rotatable_bonds: | 7 |
| MolWt: | 415.43 | Num_heavy_atoms: | 31 |
| TPSA: | 119.67 | NumAromaticRings: | 3 |
