input word = C00047780

Metabolite InformationStructural formula
Name Caniojane
Formula C20H24O5
Mw 344.16237388
CAS RN 117783-27-4
C_ID C00047780 ,
InChIKey AINNPETUGJFTND-XGDSPUIANA-N
InChICode InChI=1S/C20H24O5/c1-9(2)12-5-6-19-8-23-20(25-24-19)11(4)18(22)14-16(20)15(19)13(12)7-10(3)17(14)21/h7,11-13,15,18,22H,1,5-6,8H2,2-4H3/t11-,12+,13-,15+,18-,19-,20-/m1/s1
SMILES C12=C3C(=O)C(=C[C@H]4[C@@H]1[C@]1(CC[C@H]4C(=C)C)OO[C@@]2([C@@H]([C@H]3O)C)OC1)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeJatropha integerrima Ref.
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OrganismJatropha integerrima
ReferenceSutthivaiyakit,J.Nat.Prod.,72,(2009),2024