input word = C00046126

Metabolite InformationStructural formula
Name Mappain
Formula C29H36O4
Mw 448.26135964
CAS RN 319915-14-5
C_ID C00046126 ,
InChIKey GJZKDVGLDGLPMB-ZVBRSKEYSA-N
InChICode InChI=1S/C29H36O4/c1-19(2)7-6-8-21(5)10-13-24-15-22(18-28(32)29(24)33)11-12-23-16-26(30)25(27(31)17-23)14-9-20(3)4/h7,9-12,15-18,30-33H,6,8,13-14H2,1-5H3/b12-11+,21-10+
SMILES CC(C)=CCC/C(C)=C/Cc1cc(/C=C/c2cc(O)c(CC=C(C)C)c(O)c2)cc(O)c1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeMacaranga mappa Ref.
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