Glycoside
GD047082
Name:
NoneFormula:
C11H15O6N5Smiles:
COc1nc2c(=O)[nH]c(N)nc2n1[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1OAglycone:
COC1=Nc2c(nc(N)[nH]c2=O)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.55 |
| AlogP: | -2.68 | Num_rotatable_bonds: | 3 |
| MolWt: | 313.27 | Num_heavy_atoms: | 22 |
| TPSA: | 168.74 | NumAromaticRings: | 2 |
Unique Aglycone
AD15838
Formula: C6H6O2N5
Smiles:
COC1=Nc2c(nc(N)[nH]c2=O)[N]1| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.17 |
| AlogP: | -0.76 | Num_rotatable_bonds: | 0 |
| MolWt: | 180.15 | Num_heavy_atoms: | 13 |
| TPSA: | 107.46 | NumAromaticRings: | 1 |
