Chemical Component Summary

Name5-[(3S)-1,2-dithiolan-3-yl]pentanoic acid
Identifiers5-[(3S)-1,2-dithiolan-3-yl]pentanoic acid
FormulaC8 H14 O2 S2
Molecular Weight206.326
TypeNON-POLYMER
Isomeric SMILESC1CSS[C@H]1CCCCC(=O)O
InChIInChI=1S/C8H14O2S2/c9-8(10)4-2-1-3-7-5-6-11-12-7/h7H,1-6H2,(H,9,10)/t7-/m0/s1
InChIKeyAGBQKNBQESQNJD-ZETCQYMHSA-N

Chemical Details

Formal Charge0
Atom Count26
Chiral Atom Count1
Bond Count26
Aromatic Bond Count0

Related Resource References

Resource NameReference
PubChem 445125
ChEMBL CHEMBL1234071
ChEBI CHEBI:43796
CCDC/CSD HAXJIB, ITATEF