Glycoside
GD118991
Name:
NoneFormula:
C23H41O19NSSmiles:
CC(OC1OC(CO)C(OC2OC(CO)C(OC3OC(C)C(O)C(O)C3O)C(O)C2O)C(O)C1O)C(O)=NCCS(=O)(=O)OAglycone:
CC(O)C(O)=NCCS(=O)(=O)OSugarmoiety:
CC1OC(OC2C(CO)OC(OC3C(CO)OC(O)C(O)C3O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 20 | RingCount: | 3 |
| HBD: | 11 | FractionCSP3: | 0.96 |
| AlogP: | -6.29 | Num_rotatable_bonds: | 12 |
| MolWt: | 667.64 | Num_heavy_atoms: | 44 |
| TPSA: | 324.41 | NumAromaticRings: | 0 |
Unique Aglycone
AD47622
Formula: C5H11O5NS
Smiles:
CC(O)C(O)=NCCS(=O)(=O)O| HBA: | 6 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 0.8 |
| AlogP: | -0.79 | Num_rotatable_bonds: | 4 |
| MolWt: | 197.21 | Num_heavy_atoms: | 12 |
| TPSA: | 107.19 | NumAromaticRings: | 0 |
