input word = C00055438

Metabolite InformationStructural formula
Name Cycloalliin
Formula C6H11NO3S
Mw 177.04596396
CAS RN 455-41-4
C_ID C00055438
InChIKey JYMHODZXTIGVPA-OHYCWAGJSA-N
InChICode InChI=1S/C6H11NO3S/c1-4-2-11(10)3-5(7-4)6(8)9/h4-5,7H,2-3H2,1H3,(H,8,9)/t4-,5-,11?/m0/s1
SMILES C[C@H]1CS(=O)C[C@@H](C(=O)O)N1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAlliaceaeAllium cepa Ref.
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OrganismAllium cepa
ReferenceVirtanen, A.I. et al., Acta Chem. Scand., 1959, 19, 2257 (Cycloalliin, synth, biosynth)