ID C0037  
Compound name 5-Methylsulfinyl-n-pentylglucosinolate
Stereochemistry -
Aracyc name 5-Methylsulfinylpentyl glucosinolate
External link   http://pmn.plantcyc.org/ARA/NEW-IMAGE?type=COMPOUND&object=CPDQT-284
Mass information 1st experiment  :  compound_URL_list_20130127_edit.txtLC-Q-TOF/MS (Negative ion mode)
2nd experiment  :  compound_URL_list_20130127_edit.txtLC-Q-TOF/MS (Negative ion mode)
Molecular Formula H24N1O10C13S3
Canonical SMILES C(S(=O)C)CCCCC(=NOS(=O)(=O)[O-])SC1(C(O)C(O)C(O)C(CO)O1)
Molecular Weight 451.521
Pathway Information glucosinolate biosynthesis from trihomomethionine
CAS ID 499-37-6
Synonym glucoalyssin; beta-D-glucopyranose, 1-thio-, 1-(6-(methylsulfinyl)-N-(sulfooxy)hexanimidate)
External ID PUBCHEM:44237260, KNAPSACK:C00007345