input word = C00035412

Metabolite InformationStructural formula
Name Thiophanic acid
Formula C14H6Cl4O5
Mw 393.89693414
CAS RN 7584-33-0
C_ID C00035412 ,
InChIKey MYBIAUJNAXMGTF-UHFFFAOYSA-N
InChICode InChI=1S/C14H6Cl4O5/c1-2-3-9(19)4-10(20)6(16)12(22)8(18)14(4)23-13(3)7(17)11(21)5(2)15/h20-22H,1H3
SMILES c12c(oc3c(c1=O)c(c(c(c3Cl)O)Cl)O)c(c(c(c2C)Cl)O)Cl
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Lecanora iseana Ref.
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OrganismLecanora iseana
ReferenceTakenaka,Phytochem.,66,(2005),665