Glycoside
GD102515
Name:
NoneFormula:
C19H20O6N6SSmiles:
COC(=O)c1cccc(NC(=S)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1Aglycone:
COC(=O)c1cccc(NC(=S)Nc2ncnc3c2N=C[N]3)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.32 |
| AlogP: | 0.03 | Num_rotatable_bonds: | 5 |
| MolWt: | 460.47 | Num_heavy_atoms: | 32 |
| TPSA: | 163.88 | NumAromaticRings: | 3 |
Unique Aglycone
AD43392
Formula: C14H11O2N6S
Smiles:
COC(=O)c1cccc(NC(=S)Nc2ncnc3c2N=C[N]3)c1| HBA: | 8 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.07 |
| AlogP: | 1.98 | Num_rotatable_bonds: | 3 |
| MolWt: | 327.35 | Num_heavy_atoms: | 23 |
| TPSA: | 102.6 | NumAromaticRings: | 2 |
