Glycoside
GD085157
Name:
NoneFormula:
C16H21O6N5SSmiles:
C=CCC1(S(=O)(=O)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)CC1Aglycone:
C=CCC1(S(=O)(=O)Nc2ncnc3c2N=C[N]3)CC1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.56 |
| AlogP: | -0.71 | Num_rotatable_bonds: | 7 |
| MolWt: | 411.44 | Num_heavy_atoms: | 28 |
| TPSA: | 159.69 | NumAromaticRings: | 2 |
Unique Aglycone
AD38093
Formula: C11H12O2N5S
Smiles:
C=CCC1(S(=O)(=O)Nc2ncnc3c2N=C[N]3)CC1| HBA: | 7 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.36 |
| AlogP: | 1.24 | Num_rotatable_bonds: | 5 |
| MolWt: | 278.32 | Num_heavy_atoms: | 19 |
| TPSA: | 98.41 | NumAromaticRings: | 1 |
