input word = C00009987

Metabolite InformationStructural formula
Name Repenone
6a,12a-Dehydro-9,10,11-trihydroxy-6-acetoxyrotenone
Formula C18H12O8
Mw 356.05321736
CAS RN 128486-15-7
C_ID C00009987 ,
InChIKey IFAQBCFCOHMCTL-UHFFFAOYNA-N
InChICode InChI=1S/C18H12O8/c1-7(19)24-18-17-12(8-4-2-3-5-10(8)26-18)15(22)13-11(25-17)6-9(20)14(21)16(13)23/h2-6,18,20-21,23H,1H3/t18-/m1/s1
SMILES CC(=O)OC1Oc2ccccc2-c2c1oc1cc(O)c(O)c(O)c1c2=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeNyctaginaceaeBoerhavia repens Ref.
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OrganismBoerhavia repens
ReferenceHarborne, The Handbook of Natural Flavonoids, 2, (1999), 517,Isoflavonoids and neoflavonoids

Ahmed,Phytochem.,29,(1990),1709