Glycoside
GD069838
Name:
NoneFormula:
C17H21O6N3Smiles:
CN(C[C@H](O)[C@H](O)[C@H](O)[C@@H](O)CO)c1oc(-c2ccccc2)nc1C#NAglycone:
CN(C)c1oc(-c2ccccc2)nc1C#NSugarmoiety:
OCC(O)C(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.41 |
| AlogP: | -0.91 | Num_rotatable_bonds: | 8 |
| MolWt: | 363.37 | Num_heavy_atoms: | 26 |
| TPSA: | 154.21 | NumAromaticRings: | 2 |
Unique Aglycone
AD33090
Formula: C12H11ON3
Smiles:
CN(C)c1oc(-c2ccccc2)nc1C#N| HBA: | 4 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.17 |
| AlogP: | 2.28 | Num_rotatable_bonds: | 2 |
| MolWt: | 213.24 | Num_heavy_atoms: | 16 |
| TPSA: | 53.06 | NumAromaticRings: | 2 |
