Glycoside
GD085250
Name:
NoneFormula:
C15H13O7NClBrSmiles:
O=C(O)[C@@H]1O[C@H](Oc2c[nH]c3ccc(Br)c(Cl)c23)[C@@H](O)[C@H](O)[C@H]1OAglycone:
Oc1c[nH]c2ccc(Br)c(Cl)c12Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.36 |
| AlogP: | 0.85 | Num_rotatable_bonds: | 3 |
| MolWt: | 422.62 | Num_heavy_atoms: | 24 |
| TPSA: | 132.24 | NumAromaticRings: | 2 |
Unique Aglycone
AD08346
Formula: C9H5ONClBr
Smiles:
Oc1c[nH]c2ccc(Br)c(Cl)c12| HBA: | 2 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 3.29 | Num_rotatable_bonds: | 0 |
| MolWt: | 246.49 | Num_heavy_atoms: | 12 |
| TPSA: | 36.02 | NumAromaticRings: | 2 |
