input word = C00008654

Metabolite InformationStructural formula
Name Diplacol
Formula C25H28O7
Mw 440.18350325
CAS RN 76556-05-3
C_ID C00008654 ,
InChIKey UESFDRVOHWXYIQ-VGOFMYFVNA-N
InChICode InChI=1S/C25H28O7/c1-13(2)5-4-6-14(3)7-9-16-18(27)12-20-21(22(16)29)23(30)24(31)25(32-20)15-8-10-17(26)19(28)11-15/h5,7-8,10-12,24-29,31H,4,6,9H2,1-3H3/b14-7+/t24-,25+/m1/s1
SMILES CC(C)=CCC/C(C)=C/Cc1c(O)cc2c(c1O)C(=O)C(O)C(c1ccc(O)c(O)c1)O2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeMacaranga alnifolia Ref.
PlantaePhrymaceaeDiplacus aurantiacus Ref.
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