Glycoside
GD085641
Name:
NoneFormula:
C19H19O8NSSmiles:
Cc1nc(-c2coc3cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@@H]4O)ccc3c2=O)cs1Aglycone:
Cc1nc(-c2coc3cc(O)ccc3c2=O)cs1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.37 |
| AlogP: | 0.4 | Num_rotatable_bonds: | 4 |
| MolWt: | 421.43 | Num_heavy_atoms: | 29 |
| TPSA: | 142.48 | NumAromaticRings: | 3 |
Unique Aglycone
AD38142
Formula: C13H9O3NS
Smiles:
Cc1nc(-c2coc3cc(O)ccc3c2=O)cs1| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.08 |
| AlogP: | 2.93 | Num_rotatable_bonds: | 1 |
| MolWt: | 259.29 | Num_heavy_atoms: | 18 |
| TPSA: | 63.33 | NumAromaticRings: | 3 |
