Glycoside
GD005016
Name:
NoneFormula:
C18H25O8NSmiles:
CC(=Cc1ccc(O[C@@H]2O[C@H]([C@H](C)O)[C@H](O)[C@H]2O)c(O)c1)C(=O)NCCOAglycone:
CC(=Cc1ccc(O)c(O)c1)C(=O)NCCOSugarmoiety:
CC(O)C1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | -0.89 | Num_rotatable_bonds: | 7 |
| MolWt: | 383.4 | Num_heavy_atoms: | 27 |
| TPSA: | 148.71 | NumAromaticRings: | 1 |
Unique Aglycone
AD04301
Formula: C12H15O4N
Smiles:
CC(=Cc1ccc(O)c(O)c1)C(=O)NCCO| HBA: | 5 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.25 |
| AlogP: | 0.61 | Num_rotatable_bonds: | 4 |
| MolWt: | 237.25 | Num_heavy_atoms: | 17 |
| TPSA: | 89.79 | NumAromaticRings: | 1 |
