Glycoside
GD085237
Name:
NoneFormula:
C19H34O7N3Smiles:
C[C@@H]1O[C@@H](OCC[NH2+][C@H]2CCN(C(=O)OC(C)(C)C)[C@H](C#N)C2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
CC(C)(C)OC(=O)N1CCC([NH2+]CCO)CC1C#NSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.89 |
| AlogP: | -1.31 | Num_rotatable_bonds: | 5 |
| MolWt: | 416.5 | Num_heavy_atoms: | 29 |
| TPSA: | 149.09 | NumAromaticRings: | 0 |
Unique Aglycone
AD38131
Formula: C13H24O3N3
Smiles:
CC(C)(C)OC(=O)N1CCC([NH2+]CCO)CC1C#N| HBA: | 6 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.85 |
| AlogP: | -0.17 | Num_rotatable_bonds: | 3 |
| MolWt: | 270.35 | Num_heavy_atoms: | 19 |
| TPSA: | 90.17 | NumAromaticRings: | 0 |
