Glycoside
GD038612
Name:
(1s)-1,5-anhydro-1-(ethylsulfonyl)-d-glucitolFormula:
C8H16O7SSmiles:
CCS(=O)(=O)[C@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@@H]1OAglycone:
CC[S](=O)=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 1.0 |
| AlogP: | -2.78 | Num_rotatable_bonds: | 3 |
| MolWt: | 256.28 | Num_heavy_atoms: | 16 |
| TPSA: | 124.29 | NumAromaticRings: | 0 |
Unique Aglycone
AD24071
Formula: C2H5O2S
Smiles:
CC[S](=O)=O| HBA: | 2 | RingCount: | 0 |
| HBD: | 0 | FractionCSP3: | 1.0 |
| AlogP: | -0.11 | Num_rotatable_bonds: | 1 |
| MolWt: | 93.13 | Num_heavy_atoms: | 5 |
| TPSA: | 34.14 | NumAromaticRings: | 0 |
