Glycoside
GD022709
Name:
NoneFormula:
C19H21O6NSSmiles:
OC[C@@H]1O[C@H](SC(=NO)c2ccc(-c3ccccc3)cc2)[C@H](O)[C@H](O)[C@H]1OAglycone:
ON=C(S)c1ccc(-c2ccccc2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.32 |
| AlogP: | 1.02 | Num_rotatable_bonds: | 4 |
| MolWt: | 391.45 | Num_heavy_atoms: | 27 |
| TPSA: | 122.74 | NumAromaticRings: | 2 |
Unique Aglycone
AD15362
Formula: C13H11ONS
Smiles:
ON=C(S)c1ccc(-c2ccccc2)cc1| HBA: | 2 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 3.42 | Num_rotatable_bonds: | 2 |
| MolWt: | 229.3 | Num_heavy_atoms: | 16 |
| TPSA: | 32.59 | NumAromaticRings: | 2 |
