Glycoside
GD011683
Name:
NoneFormula:
C19H22O6N4Smiles:
COc1ccc(Cn2cnc3c(C)nn(C4O[C@H](CO)[C@H](O)[C@H]4O)c3c2=O)cc1Aglycone:
COc1ccc(Cn2cnc3c(c2=O)[N]N=C3C)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.42 |
| AlogP: | -0.43 | Num_rotatable_bonds: | 5 |
| MolWt: | 402.41 | Num_heavy_atoms: | 29 |
| TPSA: | 131.86 | NumAromaticRings: | 3 |
Unique Aglycone
AD08897
Formula: C14H13O2N4
Smiles:
COc1ccc(Cn2cnc3c(c2=O)[N]N=C3C)cc1| HBA: | 6 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.21 |
| AlogP: | 1.27 | Num_rotatable_bonds: | 3 |
| MolWt: | 269.28 | Num_heavy_atoms: | 20 |
| TPSA: | 70.58 | NumAromaticRings: | 2 |
