input word = C00027001

Metabolite InformationStructural formula
Name Bismurrayaquinone A
Formula C26H16N2O4
Mw 420.11100701
CAS RN 155519-86-1
C_ID C00027001 ,
InChIKey FKJFKIPTKQPIFB-UHFFFAOYSA-N
InChICode InChI=1S/C26H16N2O4/c1-11-17(25(31)21-19(23(11)29)13-7-3-5-9-15(13)27-21)18-12(2)24(30)20-14-8-4-6-10-16(14)28-22(20)26(18)32/h3-10,27-28H,1-2H3
SMILES c1ccc2c(c1)c1c([nH]2)C(=O)C(=C(C1=O)C)C1=C(C(=O)c2c([nH]c3c2cccc3)C1=O)C
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate
Organism
Kingdom Family Species Reference
PlantaeRutaceaeMurraya koenigii Ref.
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