Glycoside
GD076454
Name:
NoneFormula:
C19H25O6N3Smiles:
N#Cc1ccccc1N1CCC(C(=O)N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)CC1Aglycone:
N#Cc1ccccc1N1CCC(C(N)=O)CC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.58 |
| AlogP: | -1.31 | Num_rotatable_bonds: | 4 |
| MolWt: | 391.42 | Num_heavy_atoms: | 28 |
| TPSA: | 146.28 | NumAromaticRings: | 1 |
Unique Aglycone
AD35253
Formula: C13H15ON3
Smiles:
N#Cc1ccccc1N1CCC(C(N)=O)CC1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.38 |
| AlogP: | 1.26 | Num_rotatable_bonds: | 2 |
| MolWt: | 229.28 | Num_heavy_atoms: | 17 |
| TPSA: | 70.12 | NumAromaticRings: | 1 |
