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CHEBI:169754 - xi-7-Hydroxyhexadecanedioic acid

ChEBI IDCHEBI:169754
ChEBI Namexi-7-Hydroxyhexadecanedioic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H30O5
Net Charge0
Average Mass302.411
Monoisotopic Mass302.20932
SMILESO=C(O)CCCCCCCCC(O)CCCCCC(=O)O
InChIInChI=1S/C16H30O5/c17-14(11-7-5-9-13-16(20)21)10-6-3-1-2-4-8-12-15(18)19/h14,17H,1-13H2,(H,18,19)(H,20,21)
InChIKeyBNKCVLYEVLBHCL-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
xi-7-Hydroxyhexadecanedioic acid (CHEBI:169754) is a long-chain fatty acid (CHEBI:15904)
IUPAC Name 
7-hydroxyhexadecanedioic acid
Manual XrefsDatabases
21237667ChemSpider
HMDB0037830HMDB
LMFA01170058LIPID MAPS