Glycoside
GD054621
Name:
NoneFormula:
C13H15O7N2ClSmiles:
O=C(N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)c1[nH]c(=O)ccc1ClAglycone:
NC(=O)c1[nH]c(=O)ccc1ClSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | -2.44 | Num_rotatable_bonds: | 3 |
| MolWt: | 334.71 | Num_heavy_atoms: | 22 |
| TPSA: | 152.11 | NumAromaticRings: | 1 |
Unique Aglycone
AD27835
Formula: C7H5O2N2Cl
Smiles:
NC(=O)c1[nH]c(=O)ccc1Cl| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 0.13 | Num_rotatable_bonds: | 1 |
| MolWt: | 172.57 | Num_heavy_atoms: | 11 |
| TPSA: | 75.95 | NumAromaticRings: | 1 |
