input word = C00037824

Metabolite InformationStructural formula
Name Sinalbin B
Formula C12H12N2OS2
Mw 264.03910448
CAS RN 326473-28-3
C_ID C00037824 ,
InChIKey JCYHQSOLTRRNNC-UHFFFAOYSA-N
InChICode InChI=1S/C12H12N2OS2/c1-15-14-10-6-4-3-5-8(10)9-7-13-12(16-2)17-11(9)14/h3-6H,7H2,1-2H3
SMILES c12c(c3c(n1OC)SC(=NC3)SC)cccc2
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeCruciferaeSinapis alba Ref.
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OrganismSinapis alba
ReferencePedras,Phytochem.,55,(2000),213