input word = C00028055

Metabolite InformationStructural formula
Name Circumdatin C
Formula C17H13N3O3
Mw 307.0956913
CAS RN 223130-61-8
C_ID C00028055 ,
InChIKey RZQWOVDHZGSLCQ-IMWMWJONNA-N
InChICode InChI=1S/C17H13N3O3/c1-9-15-19-13-5-3-2-4-11(13)17(23)20(15)14-7-6-10(21)8-12(14)16(22)18-9/h2-9,21H,1H3,(H,18,22)/t9-/m0/s1
SMILES n12c([C@@H](NC(=O)c3c1ccc(c3)O)C)nc1c(c2=O)cccc1
Start Substs in Alk. Biosynthesis (Prediction) Anthranilate
Organism
Kingdom Family Species Reference
FungiTrichocomaceaeAspergillus ochraceus Ref.
--Exophiala sp. Ref.
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