Glycoside
GD090996
Name:
NoneFormula:
C21H28O8N2Smiles:
CC(C)(C)OC(=O)n1cc(CC(=O)N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)c2ccccc21Aglycone:
CC(C)(C)OC(=O)n1cc(CC(N)=O)c2ccccc21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.52 |
| AlogP: | -0.12 | Num_rotatable_bonds: | 4 |
| MolWt: | 436.46 | Num_heavy_atoms: | 31 |
| TPSA: | 150.48 | NumAromaticRings: | 2 |
Unique Aglycone
AD39635
Formula: C15H18O3N2
Smiles:
CC(C)(C)OC(=O)n1cc(CC(N)=O)c2ccccc21| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 2.45 | Num_rotatable_bonds: | 2 |
| MolWt: | 274.32 | Num_heavy_atoms: | 20 |
| TPSA: | 74.32 | NumAromaticRings: | 2 |
