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CHEBI:182265 - [(1S,2S,5R)-2-hydroxy-2-methyl-5-prop-1-en-2-ylcyclohexyl] benzoate

ChEBI IDCHEBI:182265
ChEBI Name[(1S,2S,5R)-2-hydroxy-2-methyl-5-prop-1-en-2-ylcyclohexyl] benzoate
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SubmitterMetaboLights
DownloadsMolfile
FormulaC17H22O3
Net Charge0
Average Mass274.360
Monoisotopic Mass274.15689
SMILESC=C(C)[C@@H]1CC[C@](C)(O)[C@@H](OC(=O)c2ccccc2)C1
InChIInChI=1S/C17H22O3/c1-12(2)14-9-10-17(3,19)15(11-14)20-16(18)13-7-5-4-6-8-13/h4-8,14-15,19H,1,9-11H2,2-3H3/t14-,15+,17+/m1/s1
InChIKeyKGTUUJMNKKRNKR-VYDXJSESSA-N
ChEBI Ontology
Outgoing Relation(s)
[(1S,2S,5R)-2-hydroxy-2-methyl-5-prop-1-en-2-ylcyclohexyl] benzoate (CHEBI:182265) is a monoterpenoid (CHEBI:25409)
IUPAC Name 
[(1S,2S,5R)-2-hydroxy-2-methyl-5-prop-1-en-2-ylcyclohexyl] benzoate
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