input word = C00047938

Metabolite InformationStructural formula
Name Jatrophadioxan
(-)-Jatrophadioxan
Formula C25H28O5
Mw 408.193674
CAS RN 1192839-20-5
C_ID C00047938 ,
InChIKey HHFGXBZQVLHYPI-NAXSFZCQNA-N
InChICode InChI=1S/C25H28O5/c1-13(2)16-7-6-15(4)25-18(11-16)14(3)10-20(25)28-23-19(27-5)12-17-8-9-21(26)29-22(17)24(23)30-25/h8-9,12,15-16,20H,1,6-7,10-11H2,2-5H3/t15-,16-,20-,25+/m0/s1
SMILES C=C(C)C1CC[C@H](C)[C@]23Oc4c(c(OC)cc5ccc(=O)oc45)O[C@H]2CC(C)=C3C1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeJatropha integerrima Ref.
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