Glycoside
GD088937
Name:
NoneFormula:
C15H23O10NS2Smiles:
OC[C@H]1O[C@@H](S/C(C[C@@H](O)c2ccccc2)=N\OS(O)(O)O)[C@H](O)[C@@H](O)[C@@H]1OAglycone:
OC(CC(S)=NOS(O)(O)O)c1ccccc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 8 | FractionCSP3: | 0.53 |
| AlogP: | 0.11 | Num_rotatable_bonds: | 7 |
| MolWt: | 441.48 | Num_heavy_atoms: | 28 |
| TPSA: | 192.66 | NumAromaticRings: | 1 |
Unique Aglycone
AD38887
Formula: C9H13O5NS2
Smiles:
OC(CC(S)=NOS(O)(O)O)c1ccccc1| HBA: | 6 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.22 |
| AlogP: | 2.51 | Num_rotatable_bonds: | 5 |
| MolWt: | 279.34 | Num_heavy_atoms: | 17 |
| TPSA: | 102.51 | NumAromaticRings: | 1 |
