input word = C00011284

Metabolite InformationStructural formula
Name Neoechinulin A
Formula C19H21N3O2
Mw 323.16337694
CAS RN 51551-29-2
C_ID C00011284 ,
InChIKey MYRPIYZIAHOECW-GDNBJRDFNA-N
InChICode InChI=1S/C19H21N3O2/c1-5-19(3,4)16-13(12-8-6-7-9-14(12)21-16)10-15-18(24)20-11(2)17(23)22-15/h5-11,21H,1H2,2-4H3,(H,20,24)(H,22,23)/b15-10-/t11-/m1/s1
SMILES c1c2c(ccc1)c(c([nH]2)C(C)(C)C=C)/C=C/1\NC(=O)[C@H](NC1=O)C
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate
Organism
Kingdom Family Species Reference
FungiChaetomiaceaeChaetomium globasum Ref.
FungiTrichocomaceaeAspergillus sp. Ref.
FungiTrichocomaceaeAspergillus variecolor Ref.
FungiTrichocomaceaeEurotium amstelodami Ref.
FungiTrichocomaceaeEurotium rubrum Ref.
PlantaePlumbaginaceaePlumbago zeylanica Ref.
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