Glycoside
GD075526
Name:
NoneFormula:
C16H22O6N4SSmiles:
OC[C@H]1O[C@H](O)[C@H](Nc2nc(N3CCOCC3)c3sccc3n2)[C@@H](O)[C@@H]1OAglycone:
Nc1nc(N2CCOCC2)c2sccc2n1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.62 |
| AlogP: | -1.26 | Num_rotatable_bonds: | 4 |
| MolWt: | 398.44 | Num_heavy_atoms: | 27 |
| TPSA: | 140.43 | NumAromaticRings: | 2 |
Unique Aglycone
AD34993
Formula: C10H12ON4S
Smiles:
Nc1nc(N2CCOCC2)c2sccc2n1| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.4 |
| AlogP: | 1.11 | Num_rotatable_bonds: | 1 |
| MolWt: | 236.3 | Num_heavy_atoms: | 16 |
| TPSA: | 64.27 | NumAromaticRings: | 2 |
