Glycoside
GD103204
Name:
NoneFormula:
C19H22O6N6SSmiles:
COc1ccc(NC(=S)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1OCAglycone:
COc1ccc(NC(=S)Nc2ncnc3c2N=C[N]3)cc1OCSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.37 |
| AlogP: | 0.26 | Num_rotatable_bonds: | 6 |
| MolWt: | 462.49 | Num_heavy_atoms: | 32 |
| TPSA: | 156.04 | 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 |
