Glycoside
GD103853
Name:
NoneFormula:
C19H24O7NBrSmiles:
C/C(=C\C(=O)NCCO[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1O)C(=O)c1ccc(Br)cc1Aglycone:
CC(=CC(=O)NCCO)C(=O)c1ccc(Br)cc1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.47 |
| AlogP: | 0.54 | Num_rotatable_bonds: | 7 |
| MolWt: | 458.31 | Num_heavy_atoms: | 28 |
| TPSA: | 125.32 | NumAromaticRings: | 1 |
Unique Aglycone
AD43906
Formula: C13H14O3NBr
Smiles:
CC(=CC(=O)NCCO)C(=O)c1ccc(Br)cc1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.23 |
| AlogP: | 1.69 | Num_rotatable_bonds: | 5 |
| MolWt: | 312.16 | Num_heavy_atoms: | 18 |
| TPSA: | 66.4 | NumAromaticRings: | 1 |
