Glycoside
GD050157
Name:
NoneFormula:
C13H20O6N2Smiles:
Cc1c(C(=O)N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)ccn1CAglycone:
Cc1c(C(N)=O)ccn1CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.62 |
| AlogP: | -2.14 | Num_rotatable_bonds: | 3 |
| MolWt: | 300.31 | Num_heavy_atoms: | 21 |
| TPSA: | 124.18 | NumAromaticRings: | 1 |
Unique Aglycone
AD26528
Formula: C7H10ON2
Smiles:
Cc1c(C(N)=O)ccn1C| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.29 |
| AlogP: | 0.43 | Num_rotatable_bonds: | 1 |
| MolWt: | 138.17 | Num_heavy_atoms: | 10 |
| TPSA: | 48.02 | NumAromaticRings: | 1 |
