input word = C00034561

Metabolite InformationStructural formula
Name Japodagrone
Formula C20H28O4
Mw 332.19875938
CAS RN 956357-93-0
C_ID C00034561 ,
InChIKey DIFCOVWODQVBLT-PQDZLDNPNA-N
InChICode InChI=1S/C20H28O4/c1-12-6-8-18(3,4)15-7-9-19(5,24-15)11-14-16(21)13(2)10-20(14,23)17(12)22/h10-12,15,23H,6-9H2,1-5H3/b14-11-/t12-,15+,19-,20+/m0/s1
SMILES [C@@]12(/C(=C\[C@]3(C)CC[C@H](C(CC[C@@H](C1=O)C)(C)C)O3)/C(=O)C(=C2)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeJatropha podagrica Hook Ref.
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OrganismJatropha podagrica Hook
ReferenceAiyelaagbe,Phytochem.,68,(2007),2420