Glycoside
GD071742
Name:
NoneFormula:
C16H29O8N2Smiles:
COC(C[NH+]1CC2(CCN(C(=O)[C@H]3O[C@H](O)[C@H](O)[C@@H](O)[C@H]3O)C2)C1)OCAglycone:
COC(C[NH+]1CC2(CCN(C=O)C2)C1)OCSugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.94 |
| AlogP: | -4.48 | Num_rotatable_bonds: | 5 |
| MolWt: | 377.41 | Num_heavy_atoms: | 26 |
| TPSA: | 133.36 | NumAromaticRings: | 0 |
Unique Aglycone
AD33693
Formula: C11H21O3N2
Smiles:
COC(C[NH+]1CC2(CCN(C=O)C2)C1)OC| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.91 |
| AlogP: | -1.65 | Num_rotatable_bonds: | 5 |
| MolWt: | 229.3 | Num_heavy_atoms: | 16 |
| TPSA: | 43.21 | NumAromaticRings: | 0 |
