input word = C00007852

Metabolite InformationStructural formula
Name 1-Pentenyl glucosinolate
Formula C12H21NO9S2
Mw 387.06577274
CAS RN
C_ID C00007852 ,
InChIKey HCVFEFUQVMWIGR-GCFAQIOXNA-N
InChICode InChI=1S/C12H21NO9S2/c1-2-3-4-5-8(13-22-24(18,19)20)23-12-11(17)10(16)9(15)7(6-14)21-12/h4-5,7,9-12,14-17H,2-3,6H2,1H3,(H,18,19,20)/b5-4+,13-8-/t7-,9+,10-,11-,12-/m1/s1
SMILES CCC/C=C/C(=N/OS(=O)(=O)O)S[C@H]1OC(CO)[C@H](O)C(O)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction) L-Lys
Organism
Kingdom Family Species Reference
PlantaeCruciferaeMalcolmia africana Ref.
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