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L-PROLINIUM-4-(METHYLSULFINYL)-BUTYL-GLUCOSINOLATE
SpectraBase Compound ID KZHFfPanxni
InChI InChI=1S/C12H23NO10S3.C5H9NO2/c1-25(18)5-3-2-4-8(13-23-26(19,20)21)24-12-11(17)10(16)9(15)7(6-14)22-12;7-5(8)4-2-1-3-6-4/h7,9-12,14-17H,2-6H2,1H3,(H,19,20,21);4,6H,1-3H2,(H,7,8)/b13-8+;/t7-,9-,10+,11-,12+,25?;4-/m01/s1
InChIKey LOYUNKDMLKXLSX-SMSXTPFHSA-N
Mol Weight 552.63 g/mol
Molecular Formula C17H32N2O12S3
Exact Mass 552.111738 g/mol
Enantiomer InChIKey LOYUNKDMLKXLSX-PBADBHMKSA-N
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