input word = C00042866

Metabolite InformationStructural formula
Name Propanoic acid 2-methyl-3-hydroxy-2,4,4-trimethylpentyl ester
Formula C12H24O3
Mw 216.17254463
CAS RN 373644-01-0
C_ID C00042866 ,
InChIKey WXFRFCWHHBELIH-UHFFFAOYNA-N
InChICode InChI=1S/C12H24O3/c1-8(2)11(14)15-7-9(3)10(13)12(4,5)6/h8-10,13H,7H2,1-6H3/t9-,10-/m1/s1
SMILES CC(C)C(=O)OCC(C)C(O)C(C)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Microcystis aeruginosa Ref.
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