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CHEBI:175899 - Piperenol B

ChEBI IDCHEBI:175899
ChEBI NamePiperenol B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC21H20O7
Net Charge0
Average Mass384.384
Monoisotopic Mass384.12090
SMILESO=C(OCC1(O)C=CC(OC(=O)c2ccccc2)C(O)C1O)c1ccccc1
InChIInChI=1S/C21H20O7/c22-17-16(28-20(25)15-9-5-2-6-10-15)11-12-21(26,18(17)23)13-27-19(24)14-7-3-1-4-8-14/h1-12,16-18,22-23,26H,13H2
InChIKeyPCFGXGDGOLIQTE-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Piperenol B (CHEBI:175899) is a benzoate ester (CHEBI:36054)
IUPAC Name 
(4-benzoyloxy-1,5,6-trihydroxycyclohex-2-en-1-yl)methyl benzoate
Manual XrefsDatabases
HMDB0039617HMDB
35014835ChemSpider