Glycoside
GD067699
Name:
NoneFormula:
C16H20O7N2Smiles:
CC(=O)N[C@H]1[C@H](Oc2nc3cc(C)ccc3o2)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
Cc1ccc2oc(O)nc2c1Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -0.54 | Num_rotatable_bonds: | 4 |
| MolWt: | 352.34 | Num_heavy_atoms: | 25 |
| TPSA: | 134.28 | NumAromaticRings: | 2 |
Unique Aglycone
AD32222
Formula: C8H7O2N
Smiles:
Cc1ccc2oc(O)nc2c1| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.12 |
| AlogP: | 1.84 | Num_rotatable_bonds: | 0 |
| MolWt: | 149.15 | Num_heavy_atoms: | 11 |
| TPSA: | 46.26 | NumAromaticRings: | 2 |
