Glycoside
GD053402
Name:
NoneFormula:
C12H18O7N2SSmiles:
O=S(=O)(Cc1cccnc1)N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
NS(=O)(=O)Cc1cccnc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.58 |
| AlogP: | -2.7 | Num_rotatable_bonds: | 5 |
| MolWt: | 334.35 | Num_heavy_atoms: | 22 |
| TPSA: | 149.21 | NumAromaticRings: | 1 |
Unique Aglycone
AD27266
Formula: C6H8O2N2S
Smiles:
NS(=O)(=O)Cc1cccnc1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.17 |
| AlogP: | -0.13 | Num_rotatable_bonds: | 2 |
| MolWt: | 172.21 | Num_heavy_atoms: | 11 |
| TPSA: | 73.05 | NumAromaticRings: | 1 |
