Glycoside
GD001601
Name:
NoneFormula:
C17H19O5N5SSmiles:
Nc1nc([S+]([O-])Cc2ccccc2)c2ncn(C3O[C@H](CO)[C@H](O)[C@H]3O)c2n1Aglycone:
Nc1nc2c(c([S+]([O-])Cc3ccccc3)n1)N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.35 |
| AlogP: | -0.67 | Num_rotatable_bonds: | 5 |
| MolWt: | 405.44 | Num_heavy_atoms: | 28 |
| TPSA: | 162.6 | NumAromaticRings: | 3 |
Unique Aglycone
AD01590
Formula: C12H10ON5S
Smiles:
Nc1nc2c(c([S+]([O-])Cc3ccccc3)n1)N=C[N]2| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.08 |
| AlogP: | 1.28 | Num_rotatable_bonds: | 3 |
| MolWt: | 272.31 | Num_heavy_atoms: | 19 |
| TPSA: | 101.32 | NumAromaticRings: | 2 |
