Glycoside
GD003162
Name:
NoneFormula:
C11H15O4N5SSmiles:
C[n+]1cn([C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)c2nc(N)nc([S-])c21Aglycone:
C[N+]1=C[N]c2nc(N)nc([S-])c21Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.55 |
| AlogP: | -2.64 | Num_rotatable_bonds: | 2 |
| MolWt: | 313.34 | Num_heavy_atoms: | 21 |
| TPSA: | 130.53 | NumAromaticRings: | 2 |
Unique Aglycone
AD02897
Formula: C6H6N5S
Smiles:
C[N+]1=C[N]c2nc(N)nc([S-])c21| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.17 |
| AlogP: | -0.48 | Num_rotatable_bonds: | 0 |
| MolWt: | 180.22 | Num_heavy_atoms: | 12 |
| TPSA: | 68.91 | NumAromaticRings: | 1 |
