Glycoside
GD029133
Name:
NoneFormula:
C25H28O8N2SSmiles:
CC(=O)N[C@@H]1[C@H](Oc2ccc3ccccc3c2-c2cccc(NS(C)(=O)=O)c2)O[C@H](CO)[C@H](O)[C@H]1OAglycone:
CS(=O)(=O)Nc1cccc(-c2c(O)ccc3ccccc23)c1Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.32 |
| AlogP: | 1.2 | Num_rotatable_bonds: | 7 |
| MolWt: | 516.57 | Num_heavy_atoms: | 36 |
| TPSA: | 154.42 | NumAromaticRings: | 3 |
Unique Aglycone
AD18988
Formula: C17H15O3NS
Smiles:
CS(=O)(=O)Nc1cccc(-c2c(O)ccc3ccccc23)c1| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.06 |
| AlogP: | 3.58 | Num_rotatable_bonds: | 3 |
| MolWt: | 313.38 | Num_heavy_atoms: | 22 |
| TPSA: | 66.4 | NumAromaticRings: | 3 |
