ID C0035  
Compound name 4-Methoxyindol-3-ylmethylglucosinolate
Stereochemistry -
Aracyc name 4-Methoxy-3-indolylmethyl glucosinolate
External link   http://pmn.plantcyc.org/ARA/NEW-IMAGE?type=COMPOUND&object=4-METHOXY-3-INDOLYLMETHYL-GLUCOSINOLATE
Mass information 1st experiment  :  
2nd experiment  :  compound_URL_list_20130127_edit.txtLC-Q-TOF/MS (Negative ion mode), LC-Q-TOF/MS (Positive ion mode)
Molecular Formula H21O10S2N2C17
Canonical SMILES C(SC1(OC(CO)C(O)C(O)C(O)1))(=NOS(=O)(=O)[O-])CC3(=CNC2(C=CC=C(OC)C=23))
Molecular Weight 478.488
Pathway Information glucosinolate biosynthesis from tryptophan,
indole glucosinolate breakdown (active in intact plant cell)
CAS ID 83327-21-3
Synonym 4-methoxyindol-3-ylmethylglucosinolate; 4-methyoxyglucobrassicin
External ID PUBCHEM:49859627, KNAPSACK:C00000128