Glycoside
GD078770
Name:
NoneFormula:
C13H19O6N2BrSmiles:
CCc1cc([N+](=O)[O-])c(NC[C@@H](O)[C@@H](O)[C@H](O)CO)cc1BrAglycone:
CCc1cc([N+](=O)[O-])c(NC)cc1BrSugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.54 |
| AlogP: | 0.41 | Num_rotatable_bonds: | 8 |
| MolWt: | 379.21 | Num_heavy_atoms: | 22 |
| TPSA: | 136.09 | NumAromaticRings: | 1 |
Unique Aglycone
AD36201
Formula: C9H11O2N2Br
Smiles:
CCc1cc([N+](=O)[O-])c(NC)cc1Br| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.33 |
| AlogP: | 2.96 | Num_rotatable_bonds: | 3 |
| MolWt: | 259.1 | Num_heavy_atoms: | 14 |
| TPSA: | 55.17 | NumAromaticRings: | 1 |
