input word = C00027082

Metabolite InformationStructural formula
Name Tsitsikammamine A
Formula C18H13N3O2
Mw 303.10077668
CAS RN 183114-86-5
C_ID C00027082 ,
InChIKey YEAXSAGTEKAYBH-UHFFFAOYSA-N
InChICode InChI=1S/C18H13N3O2/c22-11-3-1-9(2-4-11)12-8-21-17-14(12)15-13-10(5-6-19-15)7-20-16(13)18(17)23/h1-4,7-8,20-22H,5-6H2
SMILES c12CCN=C3c1c(C(=O)c1c3c(c[nH]1)c1ccc(cc1)O)[nH]c2
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr L-Phe
Organism
Kingdom Family Species Reference
--Tsitsikamma favus Ref.
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