Glycoside
GD095740
Name:
NoneFormula:
C13H16O6N5SISmiles:
C=CCS(=O)(=O)Nc1nc(I)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
C=CCS(=O)(=O)Nc1nc(I)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.46 |
| AlogP: | -1.03 | Num_rotatable_bonds: | 6 |
| MolWt: | 497.27 | Num_heavy_atoms: | 26 |
| TPSA: | 159.69 | NumAromaticRings: | 2 |
Unique Aglycone
AD40808
Formula: C8H7O2N5SI
Smiles:
C=CCS(=O)(=O)Nc1nc(I)nc2c1N=C[N]2| HBA: | 7 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.12 |
| AlogP: | 0.92 | Num_rotatable_bonds: | 4 |
| MolWt: | 364.15 | Num_heavy_atoms: | 17 |
| TPSA: | 98.41 | NumAromaticRings: | 1 |
