Glycoside
GD058727
Name:
NoneFormula:
C14H21O7N3Smiles:
C#CCOCc1cn(CCO[C@]2(CO)O[C@H](CO)[C@@H](O)[C@@H]2O)nn1Aglycone:
C#CCOCc1cn(CCO)nn1Sugarmoiety:
OCC1OC(O)(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.71 |
| AlogP: | -2.75 | Num_rotatable_bonds: | 9 |
| MolWt: | 343.34 | Num_heavy_atoms: | 24 |
| TPSA: | 139.32 | 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 |
