input word = C00011554

Metabolite InformationStructural formula
Name (E,E)-(-)-2-[2-(2,2-Dimethyl-6-methylenecyclohexyl)ethyl]-1,3-butadiene-1,4-diol diacetate
Formula C19H28O4
Mw 320.19875938
CAS RN 85654-09-7
C_ID C00011554 ,
InChIKey KWZKJJBRAGTOKZ-QIYIKKHUNA-N
InChICode InChI=1S/C19H28O4/c1-14-7-6-11-19(4,5)18(14)9-8-17(13-23-16(3)21)10-12-22-15(2)20/h10,12-13,18H,1,6-9,11H2,2-5H3/b12-10+,17-13+/t18-/m0/s1
SMILES C=C1CCCC(C)(C)C1CCC(/C=C/OC(C)=O)=COC(C)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCaulerpaceaeCaulerpa flexilis Ref.
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