Glycoside
GD101289
Name:
NoneFormula:
C22H32O8N2Smiles:
CC(C)(C)OC(=O)N1CC=C(Nc2ccc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)cc2)CC1Aglycone:
CC(C)(C)OC(=O)N1CC=C(Nc2ccc(O)cc2)CC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.59 |
| AlogP: | 0.8 | Num_rotatable_bonds: | 5 |
| MolWt: | 452.5 | Num_heavy_atoms: | 32 |
| TPSA: | 140.95 | NumAromaticRings: | 1 |
Unique Aglycone
AD42853
Formula: C16H22O3N2
Smiles:
CC(C)(C)OC(=O)N1CC=C(Nc2ccc(O)cc2)CC1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.44 |
| AlogP: | 3.33 | Num_rotatable_bonds: | 2 |
| MolWt: | 290.36 | Num_heavy_atoms: | 21 |
| TPSA: | 61.8 | NumAromaticRings: | 1 |
