input word = C00000720

Metabolite InformationStructural formula
Name Justicidin D
Neojusticin A
Formula C21H14O7
Mw 378.0739528
CAS RN 27041-98-1
C_ID C00000720 ,
InChIKey WOELDRZIQLRDQB-UHFFFAOYSA-N
InChICode InChI=1S/C21H14O7/c1-23-20-12-6-17-16(27-9-28-17)5-11(12)18(13-7-24-21(22)19(13)20)10-2-3-14-15(4-10)26-8-25-14/h2-6H,7-9H2,1H3
SMILES COc1c2c(c(-c3ccc4c(c3)OCO4)c3cc4c(cc13)OCO4)COC2=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAcanthaceaeJusticia procumbens Ref.
--Rostellularia procumbens Ref.
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