input word = C00049571

Metabolite InformationStructural formula
Name Cilinaphthalide A
Formula C22H20O7
Mw 396.12090299
CAS RN 238423-03-5
C_ID C00049571 ,
InChIKey AIILOHJZHOBSKD-UHFFFAOYSA-N
InChICode InChI=1S/C22H20O7/c1-25-16-7-11(5-6-15(16)23)19-12-8-17(26-2)18(27-3)9-13(12)21(28-4)14-10-29-22(24)20(14)19/h5-9,23H,10H2,1-4H3
SMILES c12c(c(c3c(c1c1ccc(c(c1)OC)O)cc(c(c3)OC)OC)OC)COC2=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAcanthaceaeJusticia ciliata Ref.
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OrganismJusticia ciliata
ReferenceDay,J.Nat.Prod.,62,(1999),1056