Glycoside
GD045229
Name:
NoneFormula:
C13H23O5N2Smiles:
N#C[C@H]1CC[C@@H]([NH2+][C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)CC1Aglycone:
N#CC1CCC([NH3+])CC1Sugarmoiety:
OCC1OC(O)C([OH2+])C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.92 |
| AlogP: | -2.57 | Num_rotatable_bonds: | 3 |
| MolWt: | 287.34 | Num_heavy_atoms: | 20 |
| TPSA: | 130.55 | NumAromaticRings: | 0 |
Unique Aglycone
AD25251
Formula: C7H13N2
Smiles:
N#CC1CCC([NH3+])CC1| HBA: | 2 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.86 |
| AlogP: | 0.31 | Num_rotatable_bonds: | 0 |
| MolWt: | 125.2 | Num_heavy_atoms: | 9 |
| TPSA: | 51.43 | NumAromaticRings: | 0 |
