Glycoside
GD074651
Name:
NoneFormula:
C19H26O7N2Smiles:
Cc1cccc(C)c1N1C[C@@H](C(=O)N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)CC1=OAglycone:
Cc1cccc(C)c1N1CC(C(N)=O)CC1=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.58 |
| AlogP: | -1.43 | Num_rotatable_bonds: | 4 |
| MolWt: | 394.42 | Num_heavy_atoms: | 28 |
| TPSA: | 139.56 | NumAromaticRings: | 1 |
Unique Aglycone
AD34514
Formula: C13H16O2N2
Smiles:
Cc1cccc(C)c1N1CC(C(N)=O)CC1=O| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.38 |
| AlogP: | 1.14 | Num_rotatable_bonds: | 2 |
| MolWt: | 232.28 | Num_heavy_atoms: | 17 |
| TPSA: | 63.4 | NumAromaticRings: | 1 |
