Glycoside
GD014927
Name:
NoneFormula:
C16H25O7N5Smiles:
CCOC(Cn1c(N)nc2c(ncn2C2O[C@H](CO)[C@H](O)[C@H]2O)c1=O)OCCAglycone:
CCOC(Cn1c(N)nc2c(c1=O)N=C[N]2)OCCSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.69 |
| AlogP: | -1.81 | Num_rotatable_bonds: | 8 |
| MolWt: | 399.4 | Num_heavy_atoms: | 28 |
| TPSA: | 167.11 | NumAromaticRings: | 2 |
Unique Aglycone
AD10924
Formula: C11H16O3N5
Smiles:
CCOC(Cn1c(N)nc2c(c1=O)N=C[N]2)OCC| HBA: | 8 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.55 |
| AlogP: | 0.13 | Num_rotatable_bonds: | 6 |
| MolWt: | 266.28 | Num_heavy_atoms: | 19 |
| TPSA: | 105.83 | NumAromaticRings: | 1 |
