input word = C00007342

Metabolite InformationStructural formula
Name 4-Hydroxybutylglucosinolate
Formula C11H21NO10S2
Mw 391.06068736
CAS RN 35610-41-4
C_ID C00007342 ,
InChIKey QHIATSAYASRLEY-DXSTXSQHNA-N
InChICode InChI=1S/C11H21NO10S2/c13-4-2-1-3-7(12-22-24(18,19)20)23-11-10(17)9(16)8(15)6(5-14)21-11/h6,8-11,13-17H,1-5H2,(H,18,19,20)/b12-7+/t6-,8-,9+,10-,11+/m1/s1
SMILES [C@@H]1(O[C@H]([C@@H]([C@H]([C@@H]1O)O)O)S/C(=N/OS(=O)(=O)O)/CCCCO)CO
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg L-Ala
Organism
Kingdom Family Species Reference
PlantaeCapparaceaeCapparis flexuosa Ref.
PlantaeCruciferaeArabidopsis thaliana Ref.
PlantaePutranjivaceaeDrypetes gossweileri Ref.
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OrganismDrypetes gossweileri
ReferenceEttlinger,Recent Adv. Phytochem.,1,(1968),59