Glycoside
GD091406
Name:
NoneFormula:
C20H24O6N3ClSmiles:
Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
Cc1nn(Cc2ccccc2Cl)c(C)c1C(N)=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.47 |
| AlogP: | -0.27 | Num_rotatable_bonds: | 5 |
| MolWt: | 425.87 | Num_heavy_atoms: | 29 |
| TPSA: | 137.07 | NumAromaticRings: | 2 |
Unique Aglycone
AD39881
Formula: C14H14ON3Cl
Smiles:
Cc1nn(Cc2ccccc2Cl)c(C)c1C(N)=O| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.23 |
| AlogP: | 2.3 | Num_rotatable_bonds: | 3 |
| MolWt: | 263.73 | Num_heavy_atoms: | 18 |
| TPSA: | 60.91 | NumAromaticRings: | 2 |
