input word = C00007794

Metabolite InformationStructural formula
Name Benzoyloxymethyl glucosinolate
Formula C15H19NO11S2
Mw 453.03995192
CAS RN
C_ID C00007794 ,
InChIKey MOOJZGCWXISCRP-NUHURVGVNA-N
InChICode InChI=1S/C15H19NO11S2/c17-6-9-11(18)12(19)13(20)15(26-9)28-10(16-27-29(22,23)24)7-25-14(21)8-4-2-1-3-5-8/h1-5,9,11-13,15,17-20H,6-7H2,(H,22,23,24)/b16-10-/t9-,11+,12-,13+,15+/m0/s1
SMILES O=C(OC/C(=N/OS(=O)(=O)O)S[C@H]1OC(CO)[C@H](O)C(O)[C@H]1O)c1ccccc1
Start Substs in Alk. Biosynthesis (Prediction) L-Asp L-Phe
Organism
Kingdom Family Species Reference
PlantaeCruciferaeErysimum asperum Ref.
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OrganismErysimum asperum
ReferenceDaxenbichler,Phytochem.,30,(1991),2623