Glycoside
GD075049
Name:
NoneFormula:
C18H26O8N2Smiles:
O=C(N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)c1ncccc1OCC1CCOCC1Aglycone:
NC(=O)c1ncccc1OCC1CCOCC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.67 |
| AlogP: | -1.58 | Num_rotatable_bonds: | 6 |
| MolWt: | 398.41 | Num_heavy_atoms: | 28 |
| TPSA: | 150.6 | NumAromaticRings: | 1 |
Unique Aglycone
AD34732
Formula: C12H16O3N2
Smiles:
NC(=O)c1ncccc1OCC1CCOCC1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 0.99 | Num_rotatable_bonds: | 4 |
| MolWt: | 236.27 | Num_heavy_atoms: | 17 |
| TPSA: | 74.44 | NumAromaticRings: | 1 |
