Glycoside
GD081018
Name:
NoneFormula:
C17H30O7N4Smiles:
CC(=O)N[C@H]1[C@H](OCCn2cc(COC(C)(C)C)nn2)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
CC(C)(C)OCc1cn(CCO)nn1Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.82 |
| AlogP: | -1.45 | Num_rotatable_bonds: | 8 |
| MolWt: | 402.45 | Num_heavy_atoms: | 28 |
| TPSA: | 148.19 | NumAromaticRings: | 1 |
Unique Aglycone
AD31960
Formula: C9H17O2N3
Smiles:
CC(C)(C)OCc1cn(CCO)nn1| HBA: | 5 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.78 |
| AlogP: | 0.59 | Num_rotatable_bonds: | 4 |
| MolWt: | 199.25 | Num_heavy_atoms: | 14 |
| TPSA: | 60.17 | NumAromaticRings: | 1 |
