Glycoside
GD047321
Name:
NoneFormula:
C12H26O8N2Smiles:
[NH3+]C[C@H](CC[C@H]([NH3+])C(=O)O)O[C@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
[NH3+]CC(O)CCC([NH3+])C(=O)OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 11 | FractionCSP3: | 0.92 |
| AlogP: | -5.11 | Num_rotatable_bonds: | 8 |
| MolWt: | 326.35 | Num_heavy_atoms: | 22 |
| TPSA: | 191.96 | NumAromaticRings: | 0 |
Unique Aglycone
AD25415
Formula: C6H16O3N2
Smiles:
[NH3+]CC(O)CCC([NH3+])C(=O)O| HBA: | 5 | RingCount: | 0 |
| HBD: | 8 | FractionCSP3: | 0.83 |
| AlogP: | -2.94 | Num_rotatable_bonds: | 5 |
| MolWt: | 164.21 | Num_heavy_atoms: | 11 |
| TPSA: | 112.81 | NumAromaticRings: | 0 |
