Panicein D (CHEBI:183070)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	Panicein D

ChEBI ID	CHEBI:183070

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C21H24O5

Net Charge

Average Mass

356.418

Monoisotopic Mass

356.16237

InChI

InChI=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+

InChIKey

KIRQMFOOLNMKGC-SOFGYWHQSA-N

SMILES

OC(CCC1=C(C(=C(O)C=C1C)C=O)C)(C)/C=C/C2=C(O)C=CC(O)=C2

Metabolite of Species	Details
Haliclona mucosa (NCBI:txid608209)	Found in Whole Organism (NCIT:C13413) See: MetaboLights Study

ChEBI Ontology
Outgoing	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

Last Modified

22 August 2023