Glycoside
GD078638
Name:
NoneFormula:
C15H17O5N2BrSmiles:
OC[C@H]1O[C@@H](O)[C@H](Nc2nccc3cccc(Br)c23)[C@@H](O)[C@@H]1OAglycone:
Nc1nccc2cccc(Br)c12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.4 |
| AlogP: | 0.21 | Num_rotatable_bonds: | 3 |
| MolWt: | 385.21 | Num_heavy_atoms: | 23 |
| TPSA: | 115.07 | NumAromaticRings: | 2 |
Unique Aglycone
AD36136
Formula: C9H7N2Br
Smiles:
Nc1nccc2cccc(Br)c12| HBA: | 2 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.58 | Num_rotatable_bonds: | 0 |
| MolWt: | 223.07 | Num_heavy_atoms: | 12 |
| TPSA: | 38.91 | NumAromaticRings: | 2 |
