Glycoside
GD082928
Name:
NoneFormula:
C16H19O7N5SSmiles:
OC[C@H]1O[C@@H](n2cnc3c(Nc4ccc(S(O)(O)O)cc4)ncnc32)[C@H](O)[C@@H]1OAglycone:
OS(O)(O)c1ccc(Nc2ncnc3c2N=C[N]3)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.31 |
| AlogP: | 0.76 | Num_rotatable_bonds: | 5 |
| MolWt: | 425.42 | Num_heavy_atoms: | 29 |
| TPSA: | 186.24 | NumAromaticRings: | 3 |
Unique Aglycone
AD37131
Formula: C11H10O3N5S
Smiles:
OS(O)(O)c1ccc(Nc2ncnc3c2N=C[N]3)cc1| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.0 |
| AlogP: | 2.71 | Num_rotatable_bonds: | 3 |
| MolWt: | 292.3 | Num_heavy_atoms: | 20 |
| TPSA: | 124.96 | NumAromaticRings: | 2 |
