Glycoside
GD097811
Name:
NoneFormula:
C21H28O9N2Smiles:
CC(C)(C)OC(=O)N1C[C@@H]2c3c(NC(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)cccc3O[C@H]2C1Aglycone:
CC(C)(C)OC(=O)N1CC2Oc3cccc(N)c3C2C1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.57 |
| AlogP: | -0.64 | Num_rotatable_bonds: | 6 |
| MolWt: | 452.46 | Num_heavy_atoms: | 32 |
| TPSA: | 165.86 | NumAromaticRings: | 1 |
Unique Aglycone
AD41620
Formula: C15H20O3N2
Smiles:
CC(C)(C)OC(=O)N1CC2Oc3cccc(N)c3C2C1| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.53 |
| AlogP: | 2.36 | Num_rotatable_bonds: | 0 |
| MolWt: | 276.34 | Num_heavy_atoms: | 20 |
| TPSA: | 64.79 | NumAromaticRings: | 1 |
