Glycoside
GD010158
Name:
NoneFormula:
C23H25O5NSSmiles:
Cc1ccc([C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1Cc1ccc(-c2cccnc2)s1Aglycone:
Cc1ccccc1Cc1ccc(-c2cccnc2)s1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.35 |
| AlogP: | 2.22 | Num_rotatable_bonds: | 5 |
| MolWt: | 427.52 | Num_heavy_atoms: | 30 |
| TPSA: | 103.04 | NumAromaticRings: | 3 |
Unique Aglycone
AD07884
Formula: C17H15NS
Smiles:
Cc1ccccc1Cc1ccc(-c2cccnc2)s1| HBA: | 1 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.12 |
| AlogP: | 4.71 | Num_rotatable_bonds: | 3 |
| MolWt: | 265.38 | Num_heavy_atoms: | 19 |
| TPSA: | 12.89 | NumAromaticRings: | 3 |
