Glycoside
GD098621
Name:
NoneFormula:
C24H36O9N2Smiles:
COc1ccc(C2(C(=O)N[C@H]3[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)CCN(C(=O)OC(C)(C)C)CC2)cc1Aglycone:
COc1ccc(C2(C(N)=O)CCN(C(=O)OC(C)(C)C)CC2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.67 |
| AlogP: | -0.12 | Num_rotatable_bonds: | 5 |
| MolWt: | 496.56 | Num_heavy_atoms: | 35 |
| TPSA: | 158.02 | NumAromaticRings: | 1 |
Unique Aglycone
AD41944
Formula: C18H26O4N2
Smiles:
COc1ccc(C2(C(N)=O)CCN(C(=O)OC(C)(C)C)CC2)cc1| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.56 |
| AlogP: | 2.45 | Num_rotatable_bonds: | 3 |
| MolWt: | 334.42 | Num_heavy_atoms: | 24 |
| TPSA: | 81.86 | NumAromaticRings: | 1 |
