Glycoside
GD056551
Name:
NoneFormula:
C14H15O7N2ClSmiles:
O=c1occ2[nH]c(N[C@H]3[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)c(Cl)cc1-2Aglycone:
Nc1[nH]c2coc(=O)c-2cc1ClSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.46 |
| AlogP: | -1.06 | Num_rotatable_bonds: | 3 |
| MolWt: | 346.72 | Num_heavy_atoms: | 23 |
| TPSA: | 148.18 | NumAromaticRings: | 0 |
Unique Aglycone
AD28423
Formula: C8H5O2N2Cl
Smiles:
Nc1[nH]c2coc(=O)c-2cc1Cl| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 1.31 | Num_rotatable_bonds: | 0 |
| MolWt: | 184.58 | Num_heavy_atoms: | 12 |
| TPSA: | 72.02 | NumAromaticRings: | 0 |
