Glycoside
GD016306
Name:
NoneFormula:
C12H16O6N4Smiles:
Cn1c(=O)c2c(ncn2C2O[C@H](CO)[C@H](O)[C@H]2O)n(C)c1=OAglycone:
Cn1c2c(c(=O)n(C)c1=O)[N]C=N2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.58 |
| AlogP: | -2.95 | Num_rotatable_bonds: | 2 |
| MolWt: | 312.28 | Num_heavy_atoms: | 22 |
| TPSA: | 131.74 | NumAromaticRings: | 2 |
Unique Aglycone
AD11760
Formula: C7H7O2N4
Smiles:
Cn1c2c(c(=O)n(C)c1=O)[N]C=N2| HBA: | 6 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.29 |
| AlogP: | -1.01 | Num_rotatable_bonds: | 0 |
| MolWt: | 179.16 | Num_heavy_atoms: | 13 |
| TPSA: | 70.46 | NumAromaticRings: | 1 |
