Glycoside
GD082832
Name:
NoneFormula:
C15H19O8N3SSmiles:
O=S(=O)(OCc1cn([C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)nn1)c1ccccc1Aglycone:
O=S(=O)(OCC1=C[N]N=N1)c1ccccc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.47 |
| AlogP: | -1.84 | Num_rotatable_bonds: | 6 |
| MolWt: | 401.4 | Num_heavy_atoms: | 27 |
| TPSA: | 164.23 | NumAromaticRings: | 2 |
Unique Aglycone
AD37113
Formula: C9H8O3N3S
Smiles:
O=S(=O)(OCC1=C[N]N=N1)c1ccccc1| HBA: | 6 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.11 |
| AlogP: | 1.22 | Num_rotatable_bonds: | 4 |
| MolWt: | 238.25 | Num_heavy_atoms: | 16 |
| TPSA: | 82.19 | NumAromaticRings: | 1 |
