Glycoside
GD049348
Name:
NoneFormula:
C12H15O5N3SSmiles:
OC[C@H]1O[C@@H](n2cc(-c3cccs3)nn2)[C@H](O)[C@@H](O)[C@H]1OAglycone:
C1=C(c2cccs2)N=N[N]1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -1.02 | Num_rotatable_bonds: | 3 |
| MolWt: | 313.34 | Num_heavy_atoms: | 21 |
| TPSA: | 120.86 | NumAromaticRings: | 2 |
Unique Aglycone
AD26164
Formula: C6H4N3S
Smiles:
C1=C(c2cccs2)N=N[N]1| HBA: | 3 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 2.03 | Num_rotatable_bonds: | 1 |
| MolWt: | 150.19 | Num_heavy_atoms: | 10 |
| TPSA: | 38.82 | NumAromaticRings: | 1 |
