Glycoside
GD082640
Name:
NoneFormula:
C14H21O9NS2Smiles:
OC[C@@H]1O[C@@H](S/C(Cc2ccccc2)=N/OS(O)(O)O)[C@H](O)[C@H](O)[C@@H]1OAglycone:
OS(O)(O)ON=C(S)Cc1ccccc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.5 |
| AlogP: | 0.23 | Num_rotatable_bonds: | 6 |
| MolWt: | 411.45 | Num_heavy_atoms: | 26 |
| TPSA: | 172.43 | NumAromaticRings: | 1 |
Unique Aglycone
AD37088
Formula: C8H11O4NS2
Smiles:
OS(O)(O)ON=C(S)Cc1ccccc1| HBA: | 5 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.12 |
| AlogP: | 2.63 | Num_rotatable_bonds: | 4 |
| MolWt: | 249.31 | Num_heavy_atoms: | 15 |
| TPSA: | 82.28 | NumAromaticRings: | 1 |
