Glycoside
GD050732
Name:
NoneFormula:
C13H22O6N2Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)C(C)(C)C#N)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
CC(C)(C#N)C(=O)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.85 |
| AlogP: | -1.5 | Num_rotatable_bonds: | 5 |
| MolWt: | 302.33 | Num_heavy_atoms: | 21 |
| TPSA: | 132.04 | NumAromaticRings: | 0 |
Unique Aglycone
AD26711
Formula: C7H12O2N2
Smiles:
CC(C)(C#N)C(=O)NCCO| HBA: | 4 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.71 |
| AlogP: | -0.36 | Num_rotatable_bonds: | 3 |
| MolWt: | 156.19 | Num_heavy_atoms: | 11 |
| TPSA: | 73.12 | NumAromaticRings: | 0 |
