Glycoside
GD044153
Name:
NoneFormula:
C9H12O7N2Smiles:
O=c1[nH]c(=O)n([C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)cc1OAglycone:
O=c1[nH]cc(O)c(=O)[nH]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | -3.15 | Num_rotatable_bonds: | 2 |
| MolWt: | 260.2 | Num_heavy_atoms: | 18 |
| TPSA: | 145.01 | NumAromaticRings: | 1 |
Unique Aglycone
AD11507
Formula: C4H4O3N2
Smiles:
O=c1[nH]cc(O)c(=O)[nH]1| HBA: | 5 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | -1.23 | Num_rotatable_bonds: | 0 |
| MolWt: | 128.09 | Num_heavy_atoms: | 9 |
| TPSA: | 85.95 | NumAromaticRings: | 1 |
