Glycoside
GD097571
Name:
NoneFormula:
C20H26O6N5FSmiles:
CCN(CC)C(=O)c1cccc(Nc2c(C(N)=O)ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1FAglycone:
CCN(CC)C(=O)c1cccc(NC2=C(C(N)=O)N=C[N]2)c1FSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.45 |
| AlogP: | -0.04 | Num_rotatable_bonds: | 8 |
| MolWt: | 451.46 | Num_heavy_atoms: | 32 |
| TPSA: | 163.17 | NumAromaticRings: | 2 |
Unique Aglycone
AD41523
Formula: C15H17O2N5F
Smiles:
CCN(CC)C(=O)c1cccc(NC2=C(C(N)=O)N=C[N]2)c1F| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.27 |
| AlogP: | 1.02 | Num_rotatable_bonds: | 6 |
| MolWt: | 318.33 | Num_heavy_atoms: | 23 |
| TPSA: | 101.89 | NumAromaticRings: | 1 |
