Glycoside
GD103208
Name:
NoneFormula:
C21H27O6N5SSmiles:
CC(C)(C)NS(=O)(=O)c1cccc(Nc2ncnc3c2ccn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1Aglycone:
CC(C)(C)NS(=O)(=O)c1cccc(Nc2ncnc3c2C=C[N]3)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.43 |
| AlogP: | 0.86 | Num_rotatable_bonds: | 6 |
| MolWt: | 477.54 | Num_heavy_atoms: | 33 |
| TPSA: | 158.83 | NumAromaticRings: | 3 |
Unique Aglycone
AD43670
Formula: C16H18O2N5S
Smiles:
CC(C)(C)NS(=O)(=O)c1cccc(Nc2ncnc3c2C=C[N]3)c1| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 2.52 | Num_rotatable_bonds: | 4 |
| MolWt: | 344.42 | Num_heavy_atoms: | 24 |
| TPSA: | 98.08 | NumAromaticRings: | 2 |
