Glycoside
GD015486
Name:
NoneFormula:
C9H11O7NSmiles:
O=c1[nH]c(=O)c([C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)co1Aglycone:
O=c1ccoc(=O)[nH]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.56 |
| AlogP: | -2.52 | Num_rotatable_bonds: | 2 |
| MolWt: | 245.19 | Num_heavy_atoms: | 17 |
| TPSA: | 132.99 | NumAromaticRings: | 1 |
Unique Aglycone
AD11005
Formula: C4H3O3N
Smiles:
O=c1ccoc(=O)[nH]1| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | -0.67 | Num_rotatable_bonds: | 0 |
| MolWt: | 113.07 | Num_heavy_atoms: | 8 |
| TPSA: | 63.07 | NumAromaticRings: | 1 |
