Glycoside
GD028762
Name:
NoneFormula:
C20H28O7N2Smiles:
CC(=Cc1ccc(O[C@@H]2O[C@H]([C@H](C)O)[C@H](O)[C@H]2O)c(O)c1)C(=O)N1CCNCC1Aglycone:
CC(=Cc1ccc(O)c(O)c1)C(=O)N1CCNCC1Sugarmoiety:
CC(O)C1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.55 |
| AlogP: | -0.57 | Num_rotatable_bonds: | 5 |
| MolWt: | 408.45 | Num_heavy_atoms: | 29 |
| TPSA: | 131.72 | NumAromaticRings: | 1 |
Unique Aglycone
AD18755
Formula: C14H18O3N2
Smiles:
CC(=Cc1ccc(O)c(O)c1)C(=O)N1CCNCC1| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.36 |
| AlogP: | 0.93 | Num_rotatable_bonds: | 2 |
| MolWt: | 262.31 | Num_heavy_atoms: | 19 |
| TPSA: | 72.8 | NumAromaticRings: | 1 |
