Glycoside
GD049397
Name:
NoneFormula:
C13H23O6N3Smiles:
CC(C)(C)OCc1cn(C[C@H]2O[C@@H](O)[C@H](O)[C@@H](O)[C@H]2O)nn1Aglycone:
Cn1cc(COC(C)(C)C)nn1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.85 |
| AlogP: | -1.61 | Num_rotatable_bonds: | 4 |
| MolWt: | 317.34 | Num_heavy_atoms: | 22 |
| TPSA: | 130.09 | NumAromaticRings: | 1 |
Unique Aglycone
AD26161
Formula: C8H15ON3
Smiles:
Cn1cc(COC(C)(C)C)nn1| HBA: | 4 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.75 |
| AlogP: | 1.13 | Num_rotatable_bonds: | 2 |
| MolWt: | 169.23 | Num_heavy_atoms: | 12 |
| TPSA: | 39.94 | NumAromaticRings: | 1 |
