Glycoside
GD050313
Name:
NoneFormula:
C14H25O6N2Smiles:
O=C1CC[C@@H]2C[C@H]([NH2+][C@H]3[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)CCN12Aglycone:
[NH3+]C1CCN2C(=O)CCC2C1Sugarmoiety:
OCC1OC(O)C([OH2+])C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.93 |
| AlogP: | -3.5 | Num_rotatable_bonds: | 3 |
| MolWt: | 317.36 | Num_heavy_atoms: | 22 |
| TPSA: | 127.07 | NumAromaticRings: | 0 |
Unique Aglycone
AD26589
Formula: C8H15ON2
Smiles:
[NH3+]C1CCN2C(=O)CCC2C1| HBA: | 3 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.88 |
| AlogP: | -0.62 | Num_rotatable_bonds: | 0 |
| MolWt: | 155.22 | Num_heavy_atoms: | 11 |
| TPSA: | 47.95 | NumAromaticRings: | 0 |
