Glycoside
GD068936
Name:
NoneFormula:
C17H21O6NSSmiles:
Cc1c(CC(=O)N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)sc2ccccc12Aglycone:
Cc1c(CC(N)=O)sc2ccccc12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.47 |
| AlogP: | -0.33 | Num_rotatable_bonds: | 4 |
| MolWt: | 367.42 | Num_heavy_atoms: | 25 |
| TPSA: | 119.25 | NumAromaticRings: | 2 |
Unique Aglycone
AD32659
Formula: C11H11ONS
Smiles:
Cc1c(CC(N)=O)sc2ccccc12| HBA: | 2 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.18 |
| AlogP: | 2.24 | Num_rotatable_bonds: | 2 |
| MolWt: | 205.28 | Num_heavy_atoms: | 14 |
| TPSA: | 43.09 | NumAromaticRings: | 2 |
