Glycoside
GD010535
Name:
NoneFormula:
C18H18O5N4Smiles:
OCC1OC(n2cnc3c(C=C(O)c4ccccc4)ncnc32)C(O)C1OAglycone:
OC(=Cc1ncnc2c1N=C[N]2)c1ccccc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.28 |
| AlogP: | 0.49 | Num_rotatable_bonds: | 4 |
| MolWt: | 370.37 | Num_heavy_atoms: | 27 |
| TPSA: | 133.75 | NumAromaticRings: | 3 |
Unique Aglycone
AD08125
Formula: C13H9ON4
Smiles:
OC(=Cc1ncnc2c1N=C[N]2)c1ccccc1| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 2.44 | Num_rotatable_bonds: | 2 |
| MolWt: | 237.24 | Num_heavy_atoms: | 18 |
| TPSA: | 72.47 | NumAromaticRings: | 2 |
