Glycoside

GD023760
Name:
NoneFormula:
C11H21O11NS3Smiles:
C[S+]([O-])CCC(C(=O)NOS(=O)(=O)O)[C@]1(S)O[C@H](CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
C[S+]([O-])CCCC(=O)NOS(=O)(=O)OSugarmoiety:
OCC1OC(O)(S)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 12 | RingCount: | 1 |
HBD: | 6 | FractionCSP3: | 0.91 |
AlogP: | -3.68 | Num_rotatable_bonds: | 8 |
MolWt: | 439.49 | Num_heavy_atoms: | 26 |
TPSA: | 205.91 | NumAromaticRings: | 0 |
Unique Aglycone
AD15952
Formula: C5H11O6NS2
Smiles:
C[S+]([O-])CCCC(=O)NOS(=O)(=O)OHBA: | 7 | RingCount: | 0 |
HBD: | 2 | FractionCSP3: | 0.8 |
AlogP: | -1.0 | Num_rotatable_bonds: | 6 |
MolWt: | 245.28 | Num_heavy_atoms: | 14 |
TPSA: | 115.76 | NumAromaticRings: | 0 |