Glycoside
GD101005
Name:
NoneFormula:
C24H32O8N2Smiles:
C[C@H](C(=O)N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)N(C(=O)OC(C)(C)C)c1cccc2ccccc12Aglycone:
CC(C(N)=O)N(C(=O)OC(C)(C)C)c1cccc2ccccc12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | 0.89 | Num_rotatable_bonds: | 5 |
| MolWt: | 476.53 | Num_heavy_atoms: | 34 |
| TPSA: | 148.79 | NumAromaticRings: | 2 |
Unique Aglycone
AD42695
Formula: C18H22O3N2
Smiles:
CC(C(N)=O)N(C(=O)OC(C)(C)C)c1cccc2ccccc12| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 3.46 | Num_rotatable_bonds: | 3 |
| MolWt: | 314.38 | Num_heavy_atoms: | 23 |
| TPSA: | 72.63 | NumAromaticRings: | 2 |
