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CHEBI:183070 - Panicein D

ChEBI IDCHEBI:183070
ChEBI NamePanicein D
Stars
Last Modified22 August 2023
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H24O5
Net Charge0
Average Mass356.418
Monoisotopic Mass356.16237
SMILESCc1cc(O)c(C=O)c(C)c1CCC(C)(O)/C=C/c1cc(O)ccc1O
InChIInChI=1S/C21H24O5/c1-13-10-20(25)18(12-22)14(2)17(13)7-9-21(3,26)8-6-15-11-16(23)4-5-19(15)24/h4-6,8,10-12,23-26H,7,9H2,1-3H3/b8-6+
InChIKeyKIRQMFOOLNMKGC-SOFGYWHQSA-N
Species of MetaboliteComponentSourceComments
Haliclona mucosa (ncbitaxon:608209) Whole Organism (NCIT:C13413) MetaboLights (MTBLS638)
ChEBI Ontology
Outgoing Relation(s)
Panicein D (CHEBI:183070) is a monoterpenoid (CHEBI:25409)
IUPAC Name 
3-[(E)-5-(2,5-dihydroxyphenyl)-3-hydroxy-3-methylpent-4-enyl]-6-hydroxy-2,4-dimethylbenzaldehyde
Manual XrefsDatabases
8603774ChemSpider