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CHEBI:181175 - 2-{[4-(Methylethyl)cyclohexyl]carbonylamino}-3-phenylpropanoic acid

ChEBI IDCHEBI:181175
ChEBI Name2-{[4-(Methylethyl)cyclohexyl]carbonylamino}-3-phenylpropanoic acid
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SubmitterMetaboLights
DownloadsMolfile
FormulaC19H27NO3
Net Charge0
Average Mass317.429
Monoisotopic Mass317.19909
SMILESCC(C)C1CCC(C(=O)NC(Cc2ccccc2)C(=O)O)CC1
InChIInChI=1S/C19H27NO3/c1-13(2)15-8-10-16(11-9-15)18(21)20-17(19(22)23)12-14-6-4-3-5-7-14/h3-7,13,15-17H,8-12H2,1-2H3,(H,20,21)(H,22,23)
InChIKeyOELFLUMRDSZNSF-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-{[4-(Methylethyl)cyclohexyl]carbonylamino}-3-phenylpropanoic acid (CHEBI:181175) is a phenylalanine derivative (CHEBI:25985)
IUPAC Name 
3-phenyl-2-[(4-propan-2-ylcyclohexanecarbonyl)amino]propanoic acid
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