input word = C00038653

Metabolite InformationStructural formula
Name Brunnein A
(-)-Brunnein A
Formula C13H12N2O3
Mw 244.08479226
CAS RN 955377-45-4
C_ID C00038653 ,
InChIKey KSNGZQWONODVBX-LDGXTIHJNA-N
InChICode InChI=1S/C13H12N2O3/c1-6-12-9(5-11(14-6)13(17)18)8-3-2-7(16)4-10(8)15-12/h2-4,11,15-16H,5H2,1H3,(H,17,18)/t11-/m0/s1
SMILES c12c(c3c([nH]1)C(=N[C@@H](C3)C(=O)O)C)ccc(c2)O
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
FungiCortinariaceaeCortinarius brunneus Ref.
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