Glycoside
GD047327
Name:
NoneFormula:
C14H29O6N2Smiles:
CO[C@@H]1[C@@H](O)[C@H](NC(=O)CC(C)(C)O)[C@@H](C)O[C@H]1OCC[NH3+]Aglycone:
CC(C)(O)CC(N)=OSugarmoiety:
COC1C(OCC[NH3+])OC(C)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.93 |
| AlogP: | -1.99 | Num_rotatable_bonds: | 7 |
| MolWt: | 321.39 | Num_heavy_atoms: | 22 |
| TPSA: | 124.89 | NumAromaticRings: | 0 |
Unique Aglycone
AD24879
Formula: C5H11O2N
Smiles:
CC(C)(O)CC(N)=O| HBA: | 3 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 0.8 |
| AlogP: | -0.37 | Num_rotatable_bonds: | 2 |
| MolWt: | 117.15 | Num_heavy_atoms: | 8 |
| TPSA: | 63.32 | NumAromaticRings: | 0 |
