Glycoside
GD059026
Name:
NoneFormula:
C16H17O6N3Smiles:
O=C(Nc1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)n1)c1ccccc1Aglycone:
O=C(Nc1cc[nH]c(=O)n1)c1ccccc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.31 |
| AlogP: | -0.89 | Num_rotatable_bonds: | 4 |
| MolWt: | 347.33 | Num_heavy_atoms: | 25 |
| TPSA: | 133.91 | NumAromaticRings: | 2 |
Unique Aglycone
AD05677
Formula: C11H9O2N3
Smiles:
O=C(Nc1cc[nH]c(=O)n1)c1ccccc1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.02 | Num_rotatable_bonds: | 2 |
| MolWt: | 215.21 | Num_heavy_atoms: | 16 |
| TPSA: | 74.85 | NumAromaticRings: | 2 |
