Glycoside
GD093245
Name:
NoneFormula:
C20H22O5N4SSmiles:
Cc1c(/N=N/c2ccccc2)c(C)n([C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c(=S)c1C#NAglycone:
Cc1[nH]c(=S)c(C#N)c(C)c1N=Nc1ccccc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.4 |
| AlogP: | 2.09 | Num_rotatable_bonds: | 4 |
| MolWt: | 430.49 | Num_heavy_atoms: | 30 |
| TPSA: | 143.59 | NumAromaticRings: | 2 |
Unique Aglycone
AD02781
Formula: C14H12N4S
Smiles:
Cc1[nH]c(=S)c(C#N)c(C)c1N=Nc1ccccc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | 4.65 | Num_rotatable_bonds: | 2 |
| MolWt: | 268.35 | Num_heavy_atoms: | 19 |
| TPSA: | 64.3 | NumAromaticRings: | 2 |
