3-(2,6-Dibutylbenzyl)-5-phenyl-1-benzofuran (CHEBI:188545)

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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	3-(2,6-Dibutylbenzyl)-5-phenyl-1-benzofuran

ChEBI ID	CHEBI:188545

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C29H32O

Net Charge

Average Mass

396.574

Monoisotopic Mass

396.24532

InChI

InChI=1S/C29H32O/c1-3-5-11-23-15-10-16-24(12-6-4-2)27(23)20-26-21-30-29-18-17-25(19-28(26)29)22-13-8-7-9-14-22/h7-10,13-19,21H,3-6,11-12,20H2,1-2H3

InChIKey

IGFCNMGYSGHMDO-UHFFFAOYSA-N

SMILES

O1C2=C(C(CC3=C(CCCC)C=CC=C3CCCC)=C1)C=C(C=C2)C4=CC=CC=C4

Metabolite of Species	Details
Phyllostachys violascens (NCBI:txid1903417)	Found in stem (BTO:0001300). of strain Phyllostachys violascens cv. Viridisulcata See: MetaboLights Study

ChEBI Ontology
Outgoing	3-(2,6-Dibutylbenzyl)-5-phenyl-1-benzofuran (CHEBI:188545) is a naphthofuran (CHEBI:39270)

IUPAC Name

3-[(2,6-dibutylphenyl)methyl]-5-phenyl-1-benzouran