Glycoside
GD067543
Name:
NoneFormula:
C15H19O7N3Smiles:
CCOC(=O)c1cnc(N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)c(C#N)c1Aglycone:
CCOC(=O)c1cnc(N)c(C#N)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.53 |
| AlogP: | -1.66 | Num_rotatable_bonds: | 5 |
| MolWt: | 353.33 | Num_heavy_atoms: | 25 |
| TPSA: | 165.16 | NumAromaticRings: | 1 |
Unique Aglycone
AD32187
Formula: C9H9O2N3
Smiles:
CCOC(=O)c1cnc(N)c(C#N)c1| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.22 |
| AlogP: | 0.71 | Num_rotatable_bonds: | 2 |
| MolWt: | 191.19 | Num_heavy_atoms: | 14 |
| TPSA: | 89.0 | NumAromaticRings: | 1 |
