Glycoside
GD006663
Name:
NoneFormula:
C14H12O8NClSmiles:
O=C(O)[C@@H]1O[C@H](Oc2noc3cc(Cl)ccc23)[C@H](O)[C@H](O)[C@H]1OAglycone:
Oc1noc2cc(Cl)ccc12Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.38 |
| AlogP: | -0.25 | Num_rotatable_bonds: | 3 |
| MolWt: | 345.69 | Num_heavy_atoms: | 23 |
| TPSA: | 142.48 | NumAromaticRings: | 2 |
Unique Aglycone
AD05489
Formula: C8H4O2NCl
Smiles:
Oc1noc2cc(Cl)ccc12| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 2.19 | Num_rotatable_bonds: | 0 |
| MolWt: | 169.57 | Num_heavy_atoms: | 11 |
| TPSA: | 46.26 | NumAromaticRings: | 2 |
