Glycoside
GD086587
Name:
NoneFormula:
C15H24O9N2S2Smiles:
CCOC(=O)c1sc(S(=O)(=O)NCCO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)nc1CAglycone:
CCOC(=O)c1sc(S(=O)(=O)NCCO)nc1CSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.73 |
| AlogP: | -1.25 | Num_rotatable_bonds: | 8 |
| MolWt: | 440.5 | Num_heavy_atoms: | 28 |
| TPSA: | 164.51 | NumAromaticRings: | 1 |
Unique Aglycone
AD38318
Formula: C9H14O5N2S2
Smiles:
CCOC(=O)c1sc(S(=O)(=O)NCCO)nc1C| HBA: | 7 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.56 |
| AlogP: | -0.1 | Num_rotatable_bonds: | 6 |
| MolWt: | 294.35 | Num_heavy_atoms: | 18 |
| TPSA: | 105.59 | NumAromaticRings: | 1 |
