| ID | C0045  |
| Compound name | 7-Methylthio-n-heptylglucosinolate |
| Stereochemistry | - |
| Aracyc name | 7-Methylthioheptyl glucosinolate |
| External link |
 http://pmn.plantcyc.org/ARA/NEW-IMAGE?type=COMPOUND&object=CPDQT-296
|
| 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 | H28N1O9S3C15 |
| Canonical SMILES | C(=NOS(=O)(=O)[O-])(SC1(C(O)C(O)C(O)C(CO)O1))CCCCCCCSC |
| Molecular Weight | 463.575 |
| Pathway Information | glucosinolate biosynthesis from pentahomomethionine |
| CAS ID | 80667-67-0 |
| Synonym | β-D-glucopyranose, 1-thio-, 1-[8-(methylthio)-N-(sulfooxy)octanimidate] |
| External ID | PUBCHEM:44237368, KNAPSACK:C00007353 |
information