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CHEBI:214 - (3S)-6-Hydroxy-3-isopropenyl-heptanoate

ChEBI IDCHEBI:214
ChEBI Name(3S)-6-Hydroxy-3-isopropenyl-heptanoate
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC10H18O3
Net Charge0
Average Mass186.251
Monoisotopic Mass186.12559
SMILESC=C(C)[C@@H](CCC(C)O)CC(=O)O
InChIInChI=1S/C10H18O3/c1-7(2)9(6-10(12)13)5-4-8(3)11/h8-9,11H,1,4-6H2,2-3H3,(H,12,13)/t8?,9-/m0/s1
InChIKeyNQYDFAGFKCSWGI-GKAPJAKFSA-N
ChEBI Ontology
Outgoing Relation(s)
(3S)-6-Hydroxy-3-isopropenyl-heptanoate (CHEBI:214) is a carbonyl compound (CHEBI:36586)
Synonyms  Source
(3S)-6-Hydroxy-3-isopropenyl-heptanoateKEGG COMPOUND
6-Hydroxy-3-isopropenylheptanoateKEGG COMPOUND
Manual XrefsDatabases
C11417KEGG COMPOUND