Glycoside
GD072171
Name:
NoneFormula:
C13H16O8N4SSmiles:
NC(=O)c1ncn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1NS(=O)(=O)c1ccco1Aglycone:
NC(=O)C1=C(NS(=O)(=O)c2ccco2)[N]C=N1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.38 |
| AlogP: | -2.01 | Num_rotatable_bonds: | 6 |
| MolWt: | 388.36 | Num_heavy_atoms: | 26 |
| TPSA: | 190.14 | NumAromaticRings: | 2 |
Unique Aglycone
AD33766
Formula: C8H7O4N4S
Smiles:
NC(=O)C1=C(NS(=O)(=O)c2ccco2)[N]C=N1| HBA: | 8 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | -1.14 | Num_rotatable_bonds: | 4 |
| MolWt: | 255.24 | Num_heavy_atoms: | 17 |
| TPSA: | 128.86 | NumAromaticRings: | 1 |
