Glycoside
GD073854
Name:
NoneFormula:
C17H30O6N4Smiles:
CC(=O)N[C@H]1[C@H](OCCn2cc(CCC(C)C)nn2)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
CC(C)CCc1cn(CCO)nn1Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.82 |
| AlogP: | -1.17 | Num_rotatable_bonds: | 9 |
| MolWt: | 386.45 | Num_heavy_atoms: | 27 |
| TPSA: | 138.96 | NumAromaticRings: | 1 |
Unique Aglycone
AD28762
Formula: C9H17ON3
Smiles:
CC(C)CCc1cn(CCO)nn1| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.78 |
| AlogP: | 0.86 | Num_rotatable_bonds: | 5 |
| MolWt: | 183.25 | Num_heavy_atoms: | 13 |
| TPSA: | 50.94 | NumAromaticRings: | 1 |
