Glycoside
GD068959
Name:
NoneFormula:
C13H21O7NS2Smiles:
Cc1ccc(S(=O)(=O)NCCO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)s1Aglycone:
Cc1ccc(S(=O)(=O)NCCO)s1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.69 |
| AlogP: | -0.82 | Num_rotatable_bonds: | 6 |
| MolWt: | 367.44 | Num_heavy_atoms: | 23 |
| TPSA: | 125.32 | NumAromaticRings: | 1 |
Unique Aglycone
AD32670
Formula: C7H11O3NS2
Smiles:
Cc1ccc(S(=O)(=O)NCCO)s1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.43 |
| AlogP: | 0.33 | Num_rotatable_bonds: | 4 |
| MolWt: | 221.3 | Num_heavy_atoms: | 13 |
| TPSA: | 66.4 | NumAromaticRings: | 1 |
