Glycoside
GD008784
Name:
NoneFormula:
C19H21O6N2ClSmiles:
Cc1cc(Cc2cc([C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)ccc2Cl)n[nH]c1=OAglycone:
Cc1cc(Cc2ccccc2Cl)n[nH]c1=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.44 |
| AlogP: | -0.16 | Num_rotatable_bonds: | 4 |
| MolWt: | 396.83 | Num_heavy_atoms: | 27 |
| TPSA: | 135.9 | NumAromaticRings: | 2 |
Unique Aglycone
AD06970
Formula: C13H11ON2Cl
Smiles:
Cc1cc(Cc2ccccc2Cl)n[nH]c1=O| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.17 |
| AlogP: | 2.32 | Num_rotatable_bonds: | 2 |
| MolWt: | 234.69 | Num_heavy_atoms: | 16 |
| TPSA: | 45.75 | NumAromaticRings: | 2 |
