Glycoside
GD025194
Name:
NoneFormula:
C22H25O7NSSmiles:
Cc1ccc(S(=O)(=O)Nc2cccc(C=CC(=O)C[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)c2)cc1Aglycone:
CC(=O)C=Cc1cccc(NS(=O)(=O)c2ccc(C)cc2)c1Sugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.32 |
| AlogP: | 1.25 | Num_rotatable_bonds: | 7 |
| MolWt: | 447.51 | Num_heavy_atoms: | 31 |
| TPSA: | 133.16 | NumAromaticRings: | 2 |
Unique Aglycone
AD04730
Formula: C17H17O3NS
Smiles:
CC(=O)C=Cc1cccc(NS(=O)(=O)c2ccc(C)cc2)c1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.12 |
| AlogP: | 3.4 | Num_rotatable_bonds: | 5 |
| MolWt: | 315.39 | Num_heavy_atoms: | 22 |
| TPSA: | 63.24 | NumAromaticRings: | 2 |
