input word = C00051934

Metabolite InformationStructural formula
Name Circumadatin E
Formula C20H17N3O4
Mw 363.12190605
CAS RN
C_ID C00051934
InChIKey
InChICode InChI=1S/C20H17N3O4/c1-27-11-9-13-17(16(24)10-11)21-18-15-7-4-8-22(15)19(25)12-5-2-3-6-14(12)23(18)20(13)26/h2-3,5-6,9-10,15,24H,4,7-8H2,1H3/t15-/m0/s1
SMILES C1(=O)c2c(n3c([C@H]4N1CCC4)nc1c(c3=O)cc(cc1O)OC)cccc2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiTrichocomaceaeAspergillus ochraceus Ref.
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