Glycoside
GD080645
Name:
NoneFormula:
C15H22O8N4SSmiles:
NC(=O)c1ncn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1NS(=O)(=O)C1CCC(=O)CC1Aglycone:
NC(=O)C1=C(NS(=O)(=O)C2CCC(=O)CC2)[N]C=N1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.67 |
| AlogP: | -2.15 | Num_rotatable_bonds: | 6 |
| MolWt: | 418.43 | Num_heavy_atoms: | 28 |
| TPSA: | 194.07 | NumAromaticRings: | 1 |
Unique Aglycone
AD36453
Formula: C10H13O4N4S
Smiles:
NC(=O)C1=C(NS(=O)(=O)C2CCC(=O)CC2)[N]C=N1| HBA: | 8 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.5 |
| AlogP: | -1.28 | Num_rotatable_bonds: | 4 |
| MolWt: | 285.3 | Num_heavy_atoms: | 19 |
| TPSA: | 132.79 | NumAromaticRings: | 0 |
