Glycoside
GD058691
Name:
NoneFormula:
C13H19O6N5Smiles:
CC(=O)N[C@H]1[C@H](OCCn2cc(C#N)nn2)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
N#Cc1cn(CCO)nn1Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.69 |
| AlogP: | -2.89 | Num_rotatable_bonds: | 6 |
| MolWt: | 341.32 | Num_heavy_atoms: | 24 |
| TPSA: | 162.75 | NumAromaticRings: | 1 |
Unique Aglycone
AD26773
Formula: C5H6ON4
Smiles:
N#Cc1cn(CCO)nn1| HBA: | 5 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.4 |
| AlogP: | -0.86 | Num_rotatable_bonds: | 2 |
| MolWt: | 138.13 | Num_heavy_atoms: | 10 |
| TPSA: | 74.73 | NumAromaticRings: | 1 |
