Record Information
Version1.0
StatusDetected and Quantified
Creation Date2021-05-15 02:34:10 UTC
Update Date2022-08-31 06:31:40 UTC
Metabolite IDMMDBc0010354
Metabolite Identification
Common NameAspirochlorine
Description
Structure
SynonymsNot Available
Molecular FormulaC12H9ClN2O5S2
Average Mass360.78
Monoisotopic Mass359.9641414
IUPAC NameNot Available
Traditional NameNot Available
CAS Registry NumberNot Available
SMILESNot Available
InChI Identifier
InChI=1S/C12H9ClN2O5S2/c1-19-15-10(17)9-14-11(18)12(15)8(21-22-9)4-2-5(13)6(16)3-7(4)20-12/h2-3,8-9,16H,1H3,(H,14,18)/t8-,9-,12+/m0/s1
InChI KeyXMFSSFONDVHNFO-HOTUBEGUSA-N