Glycoside
GD091226
Name:
NoneFormula:
C16H23O7N2BrSmiles:
CCOc1ncc(Br)cc1C(=O)NCCO[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1OAglycone:
CCOc1ncc(Br)cc1C(=O)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.62 |
| AlogP: | -0.18 | Num_rotatable_bonds: | 7 |
| MolWt: | 435.27 | Num_heavy_atoms: | 26 |
| TPSA: | 130.37 | NumAromaticRings: | 1 |
Unique Aglycone
AD39775
Formula: C10H13O3N2Br
Smiles:
CCOc1ncc(Br)cc1C(=O)NCCO| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.4 |
| AlogP: | 0.96 | Num_rotatable_bonds: | 5 |
| MolWt: | 289.13 | Num_heavy_atoms: | 16 |
| TPSA: | 71.45 | NumAromaticRings: | 1 |
