input word = C00050539

Metabolite InformationStructural formula
Name Avenalumin I
Formula C16H11NO4
Mw 281.06880785
CAS RN 78164-38-2
C_ID C00050539
InChIKey MWMMPGDUPHYPAA-FPYGCLRLSA-N
InChICode InChI=1S/C16H11NO4/c18-11-4-1-10(2-5-11)3-8-15-17-14-7-6-12(19)9-13(14)16(20)21-15/h1-9,18-19H/b8-3+
SMILES O=c1oc(/C=C/c2ccc(O)cc2)nc2ccc(O)cc12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePoaceaeAvena sativa Ref.
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OrganismAvena sativa
ReferenceSun, et al., Brief Handbook of Natural Active Compounds, Medicinal Science and Technology Press of China, Beijing, (1998).