Glycoside
GD091300
Name:
NoneFormula:
C20H24O7N4Smiles:
CCOC(=O)/C=C/c1ccc(Nc2c(C(N)=O)ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1Aglycone:
CCOC(=O)C=Cc1ccc(NC2=C(C(N)=O)N=C[N]2)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.35 |
| AlogP: | -0.09 | Num_rotatable_bonds: | 8 |
| MolWt: | 432.43 | Num_heavy_atoms: | 31 |
| TPSA: | 169.16 | NumAromaticRings: | 2 |
Unique Aglycone
AD39825
Formula: C15H15O3N4
Smiles:
CCOC(=O)C=Cc1ccc(NC2=C(C(N)=O)N=C[N]2)cc1| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.13 |
| AlogP: | 0.98 | Num_rotatable_bonds: | 6 |
| MolWt: | 299.31 | Num_heavy_atoms: | 22 |
| TPSA: | 107.88 | NumAromaticRings: | 1 |
