Glycoside
GD076345
Name:
NoneFormula:
C16H24O7N4Smiles:
C#CCOCc1cn(CCO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2NC(C)=O)nn1Aglycone:
C#CCOCc1cn(CCO)nn1Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.69 |
| AlogP: | -2.61 | Num_rotatable_bonds: | 9 |
| MolWt: | 384.39 | Num_heavy_atoms: | 27 |
| TPSA: | 148.19 | NumAromaticRings: | 1 |
Unique Aglycone
AD29333
Formula: C8H11O2N3
Smiles:
C#CCOCc1cn(CCO)nn1| HBA: | 5 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.5 |
| AlogP: | -0.58 | Num_rotatable_bonds: | 5 |
| MolWt: | 181.19 | Num_heavy_atoms: | 13 |
| TPSA: | 60.17 | NumAromaticRings: | 1 |
