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CHEBI:172914 - (+)-Zeylenol

ChEBI IDCHEBI:172914
ChEBI Name(+)-Zeylenol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H20O7
Net Charge0
Average Mass384.384
Monoisotopic Mass384.12090
SMILESO=C(OCC1(O)C(O)C=CC(OC(=O)c2ccccc2)C1O)c1ccccc1
InChIInChI=1S/C21H20O7/c22-17-12-11-16(28-20(25)15-9-5-2-6-10-15)18(23)21(17,26)13-27-19(24)14-7-3-1-4-8-14/h1-12,16-18,22-23,26H,13H2
InChIKeyAWCUZBLYCWUTRL-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2633)
ChEBI Ontology
Outgoing Relation(s)
(+)-Zeylenol (CHEBI:172914) is a benzoate ester (CHEBI:36054)
IUPAC Name 
(5-benzoyloxy-1,2,6-trihydroxycyclohex-3-en-1-yl)methyl benzoate
Manual XrefsDatabases
HMDB0029541HMDB
22370168ChemSpider