prenylterphenyllin A (CHEBI:67526)

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ChEBI Name	prenylterphenyllin A

ChEBI ID	CHEBI:67526

Definition	A para-terphenyl that is 1,1ʼ:4ʼ,1ʼʼ-terphenyl substituted by methoxy groups at positions 3ʼ and 6ʼ, a prenyl group at position 3ʼʼ and hydroxy groups at positions 2ʼ, 3, 4 and 4ʼʼ. Isolated from the fungus, Aspergillus taichungensis, it exhibits cytotoxic activity.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C25H26O6

Net Charge

Average Mass

422.47030

Monoisotopic Mass

422.17294

InChI

InChI=1S/C25H26O6/c1-14(2)5-6-16-11-15(7-9-19(16)26)18-13-22(30-3)23(24(29)25(18)31-4)17-8-10-20(27)21(28)12-17/h5,7-13,26-29H,6H2,1-4H3

InChIKey

VMYTYXJHKQRPTA-UHFFFAOYSA-N

SMILES

COc1cc(-c2ccc(O)c(CC=C(C)C)c2)c(OC)c(O)c1-c1ccc(O)c(O)c1

Metabolite of Species	Details
Aspergillus taichungensis (NCBI:txid482145)	Found in mycelium (BTO:0001436). EtOAc extract of fungal strain was isolated from root soil of Acrostichum aureum (mangrove plant) of strain ZHN 7-07 See: PubMed

Roles Classification
Biological Role(s):	Aspergillus metabolite Any fungal metabolite produced during a metabolic reaction in the mould, Aspergillus .

Application(s):	antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms.

ChEBI Ontology
Outgoing	prenylterphenyllin A (CHEBI:67526) has role Aspergillus metabolite (CHEBI:76956) prenylterphenyllin A (CHEBI:67526) has role antineoplastic agent (CHEBI:35610) prenylterphenyllin A (CHEBI:67526) is a para-terphenyl (CHEBI:75874) prenylterphenyllin A (CHEBI:67526) is a catechols (CHEBI:33566) prenylterphenyllin A (CHEBI:67526) is a dimethoxybenzene (CHEBI:51681)

IUPAC Name

3ʼ,6ʼ-dimethoxy-3ʼʼ-(3-methylbut-2-en-1-yl)-1,1ʼ:4ʼ,1ʼʼ-terphenyl-2ʼ,3,4,4ʼʼ-tetrol

Registry Number	Type	Source
21577517	Reaxys Registry Number	Reaxys

Citation	Type	Source
21486068	PubMed citation	Europe PMC

Last Modified

13 January 2014