input word = C00036837

Metabolite InformationStructural formula
Name 2,3-Dihydro-3-hydroxy-3-methylthiazolo[3,2-a]indole-9-carboxaldehyde
Brassicanal B
Formula C12H11NO2S
Mw 233.05104933
CAS RN 126654-63-5
C_ID C00036837 ,
InChIKey ZIEFIDANMCIAOW-UHFFFAOYNA-N
InChICode InChI=1S/C12H11NO2S/c1-12(15)7-16-11-9(6-14)8-4-2-3-5-10(8)13(11)12/h2-6,15H,7H2,1H3/t12-/m1/s1
SMILES c1ccc2c(c1)c(c1n2[C@](CS1)(C)O)C=O
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate
Organism
Kingdom Family Species Reference
BacteriaPseudomonadaceaePseudomonas cichorii Ref.
PlantaeCruciferaeBrassica campestris ssp.pekinensis Ref.
PlantaeCruciferaeBrassica campestris ssp.Pekinensis Ref.
PlantaeCruciferaeBrassica oleracea Ref.
PlantaeCruciferaeBrassica rapa Ref.
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OrganismBrassica campestris ssp.pekinensis
ReferenceMonde,K.et al.,Chem.Lett.,(1990),209