Glycoside
GD078663
Name:
NoneFormula:
C14H17O5NClBrSmiles:
Cc1c(Cl)cc(Br)cc1N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
Cc1c(N)cc(Br)cc1ClSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.54 |
| AlogP: | 0.62 | Num_rotatable_bonds: | 3 |
| MolWt: | 382.64 | Num_heavy_atoms: | 21 |
| TPSA: | 102.18 | NumAromaticRings: | 1 |
Unique Aglycone
AD36149
Formula: C8H7NClBr
Smiles:
Cc1c(N)cc(Br)cc1Cl| HBA: | 1 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 2.99 | Num_rotatable_bonds: | 0 |
| MolWt: | 220.5 | Num_heavy_atoms: | 10 |
| TPSA: | 26.02 | NumAromaticRings: | 1 |
