Glycoside

GD102304
Name:
NoneFormula:
C21H25O9NS2Smiles:
COc1ccc(C(=O)Nc2ccc(S[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)cc2)cc1S(C)(=O)=OAglycone:
COc1ccc(C(=O)Nc2ccc(S)cc2)cc1S(C)(=O)=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 10 | RingCount: | 3 |
HBD: | 5 | FractionCSP3: | 0.38 |
AlogP: | 0.24 | Num_rotatable_bonds: | 7 |
MolWt: | 499.56 | Num_heavy_atoms: | 33 |
TPSA: | 162.62 | NumAromaticRings: | 2 |
Unique Aglycone
AD43299
Formula: C15H15O4NS2
Smiles:
COc1ccc(C(=O)Nc2ccc(S)cc2)cc1S(C)(=O)=OHBA: | 5 | RingCount: | 2 |
HBD: | 1 | FractionCSP3: | 0.13 |
AlogP: | 2.64 | Num_rotatable_bonds: | 4 |
MolWt: | 337.42 | Num_heavy_atoms: | 22 |
TPSA: | 72.47 | NumAromaticRings: | 2 |