Glycoside
GD030009
Name:
NoneFormula:
C20H23O6NS2Smiles:
Cc1ccccc1C#Cc1ccc(S(=O)(=O)NC[C@@H]2O[C@H](C)[C@H](O)[C@H](O)[C@H]2O)s1Aglycone:
CNS(=O)(=O)c1ccc(C#Cc2ccccc2C)s1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.4 |
| AlogP: | 0.6 | Num_rotatable_bonds: | 4 |
| MolWt: | 437.54 | Num_heavy_atoms: | 29 |
| TPSA: | 116.09 | NumAromaticRings: | 2 |
Unique Aglycone
AD19454
Formula: C14H13O2NS2
Smiles:
CNS(=O)(=O)c1ccc(C#Cc2ccccc2C)s1| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | 2.36 | Num_rotatable_bonds: | 2 |
| MolWt: | 291.4 | Num_heavy_atoms: | 19 |
| TPSA: | 46.17 | NumAromaticRings: | 2 |
