Glycoside
GD103227
Name:
NoneFormula:
C25H38O8N2Smiles:
Cc1ccc(C2(CC(=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:
Cc1ccc(C2(CC(N)=O)CCN(C(=O)OC(C)(C)C)CC2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.68 |
| AlogP: | 0.57 | Num_rotatable_bonds: | 5 |
| MolWt: | 494.59 | Num_heavy_atoms: | 35 |
| TPSA: | 148.79 | NumAromaticRings: | 1 |
Unique Aglycone
AD43675
Formula: C19H28O3N2
Smiles:
Cc1ccc(C2(CC(N)=O)CCN(C(=O)OC(C)(C)C)CC2)cc1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.58 |
| AlogP: | 3.14 | Num_rotatable_bonds: | 3 |
| MolWt: | 332.44 | Num_heavy_atoms: | 24 |
| TPSA: | 72.63 | NumAromaticRings: | 1 |
