Glycoside
GD020469
Name:
NoneFormula:
C11H16O6N2Smiles:
CCc1cn([C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)c(=O)c[n+]1[O-]Aglycone:
CCc1c[nH]c(=O)c[n+]1[O-]Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.64 |
| AlogP: | -2.34 | Num_rotatable_bonds: | 3 |
| MolWt: | 272.26 | Num_heavy_atoms: | 19 |
| TPSA: | 118.86 | NumAromaticRings: | 1 |
Unique Aglycone
AD14129
Formula: C6H8O2N2
Smiles:
CCc1c[nH]c(=O)c[n+]1[O-]| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.33 |
| AlogP: | -0.43 | Num_rotatable_bonds: | 1 |
| MolWt: | 140.14 | Num_heavy_atoms: | 10 |
| TPSA: | 59.8 | NumAromaticRings: | 1 |
