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CHEBI:207859 - 12-(aminomethyl)-11-hydroxyhexanyl-10-phenylpropanoate

ChEBI IDCHEBI:207859
ChEBI Name12-(aminomethyl)-11-hydroxyhexanyl-10-phenylpropanoate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H25NO3
Net Charge0
Average Mass279.380
Monoisotopic Mass279.18344
SMILESCC[C@H](CN)[C@H](O)[C@H](C)OC(=O)CCc1ccccc1
InChIInChI=1S/C16H25NO3/c1-3-14(11-17)16(19)12(2)20-15(18)10-9-13-7-5-4-6-8-13/h4-8,12,14,16,19H,3,9-11,17H2,1-2H3/t12-,14+,16+/m0/s1
InChIKeyYGOQXDORCQDOIO-JGGQBBKZSA-N
Species of MetaboliteComponentSourceComments
Bacillus amyloliquefaciens (ncbitaxon:1390) - PubMed (28842846)
ChEBI Ontology
Outgoing Relation(s)
12-(aminomethyl)-11-hydroxyhexanyl-10-phenylpropanoate (CHEBI:207859) is a fatty acid ester (CHEBI:35748)
IUPAC Name 
[(2S,3S,4R)-4-(aminomethyl)-3-hydroxyhexan-2-yl] 3-phenylpropanoate
Manual XrefsDatabases
71048659ChemSpider