Glycoside
GD100679
Name:
NoneFormula:
C21H20O8N4SSmiles:
NC(=O)c1ncn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1NS(=O)(=O)c1ccc2oc3ccccc3c2c1Aglycone:
NC(=O)C1=C(NS(=O)(=O)c2ccc3oc4ccccc4c3c2)[N]C=N1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.24 |
| AlogP: | 0.29 | Num_rotatable_bonds: | 6 |
| MolWt: | 488.48 | Num_heavy_atoms: | 34 |
| TPSA: | 190.14 | NumAromaticRings: | 4 |
Unique Aglycone
AD42506
Formula: C16H11O4N4S
Smiles:
NC(=O)C1=C(NS(=O)(=O)c2ccc3oc4ccccc4c3c2)[N]C=N1| HBA: | 8 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 1.17 | Num_rotatable_bonds: | 4 |
| MolWt: | 355.36 | Num_heavy_atoms: | 25 |
| TPSA: | 128.86 | NumAromaticRings: | 3 |
