Glycoside
GD058743
Name:
NoneFormula:
C14H21O6N3Smiles:
C#CCCc1cn(CCO[C@]2(CO)O[C@H](CO)[C@@H](O)[C@@H]2O)nn1Aglycone:
C#CCCc1cn(CCO)nn1Sugarmoiety:
OCC1OC(O)(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.71 |
| AlogP: | -2.34 | Num_rotatable_bonds: | 8 |
| MolWt: | 327.34 | Num_heavy_atoms: | 23 |
| TPSA: | 130.09 | NumAromaticRings: | 1 |
Unique Aglycone
AD29336
Formula: C8H11ON3
Smiles:
C#CCCc1cn(CCO)nn1| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.5 |
| AlogP: | -0.16 | Num_rotatable_bonds: | 4 |
| MolWt: | 165.2 | Num_heavy_atoms: | 12 |
| TPSA: | 50.94 | NumAromaticRings: | 1 |
