Glycoside
GD065575
Name:
NoneFormula:
C16H17O8NSmiles:
O=C(N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)c1cc2ccccc2oc1=OAglycone:
NC(=O)c1cc2ccccc2oc1=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | -1.68 | Num_rotatable_bonds: | 3 |
| MolWt: | 351.31 | Num_heavy_atoms: | 25 |
| TPSA: | 149.46 | NumAromaticRings: | 2 |
Unique Aglycone
AD31541
Formula: C10H7O3N
Smiles:
NC(=O)c1cc2ccccc2oc1=O| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.89 | Num_rotatable_bonds: | 1 |
| MolWt: | 189.17 | Num_heavy_atoms: | 14 |
| TPSA: | 73.3 | NumAromaticRings: | 2 |
