Glycoside
GD103206
Name:
NoneFormula:
C20H24O6N6SSmiles:
COc1ccc(NC(=S)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2OC)cc1OCAglycone:
COc1ccc(NC(=S)Nc2ncnc3c2N=C[N]3)cc1OCSugarmoiety:
COC1C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.4 |
| AlogP: | 0.92 | Num_rotatable_bonds: | 7 |
| MolWt: | 476.52 | Num_heavy_atoms: | 33 |
| TPSA: | 145.04 | NumAromaticRings: | 3 |
Unique Aglycone
AD43666
Formula: C14H13O2N6S
Smiles:
COc1ccc(NC(=S)Nc2ncnc3c2N=C[N]3)cc1OC| HBA: | 8 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 2.21 | Num_rotatable_bonds: | 4 |
| MolWt: | 329.37 | Num_heavy_atoms: | 23 |
| TPSA: | 94.76 | NumAromaticRings: | 2 |
