Glycoside
GD031322
Name:
NoneFormula:
C25H35O11N5Smiles:
CO[C@@H]1O[C@H](CO)[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](n3cc(C(=O)NCc4ccccc4)nn3)[C@H]2O)[C@H](O)[C@H]1NC(C)=OAglycone:
O=C(NCc1ccccc1)C1=C[N]N=N1Sugarmoiety:
COC1OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C(O)C1NC(C)=OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.6 |
| AlogP: | -3.2 | Num_rotatable_bonds: | 10 |
| MolWt: | 581.58 | Num_heavy_atoms: | 41 |
| TPSA: | 226.98 | NumAromaticRings: | 2 |
Unique Aglycone
AD20194
Formula: C10H9ON4
Smiles:
O=C(NCc1ccccc1)C1=C[N]N=N1| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.1 |
| AlogP: | 1.13 | Num_rotatable_bonds: | 3 |
| MolWt: | 201.21 | Num_heavy_atoms: | 15 |
| TPSA: | 67.92 | NumAromaticRings: | 1 |
