asperentin (CHEBI:68792)

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ChEBI Name	asperentin

ChEBI ID	CHEBI:68792

Definition	A member of the class of isocoumarins that is 6,8-dihydroxy-3,4-dihydro-1H-isochromen-1-one substituted by a [6-methyltetrahydro-2H-pyran-2-yl]methyl group at position 3. It has been isolated from the fungus Chaetomium globosum and Aspergillus flavus.

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

Supplier Information

Download	Molfile XML SDF

Formula

C16H20O5

Net Charge

Average Mass

292.32700

Monoisotopic Mass

292.13107

InChI

InChI=1S/C16H20O5/c1-9-3-2-4-12(20-9)8-13-6-10-5-11(17)7-14(18)15(10)16(19)21-13/h5,7,9,12-13,17-18H,2-4,6,8H2,1H3/t9-,12+,13?/m0/s1

InChIKey

WOMKDMUZNBFXKG-XAWKZAOJSA-N

SMILES

[H][C@@]1(CCC[C@H](C)O1)CC1Cc2cc(O)cc(O)c2C(=O)O1

Metabolite of Species	Details
Chaetomium globosum (NCBI:txid38033)	See: PubMed
Aspergillus flavus (NCBI:txid5059)	See: PubMed

Roles Classification
Biological Role(s):	Chaetomium metabolite Any fungal metabolite produced during a metabolic reaction in the mould, Chaetomium. Aspergillus metabolite Any fungal metabolite produced during a metabolic reaction in the mould, Aspergillus . antifungal agent An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce. antiplasmodial drug An antiparasitic drug which is effective against Apicomplexan parasites in the genus Plasmodium. The genus contains over 200 species and includes those responsible for malaria.

Application(s):	antiplasmodial drug An antiparasitic drug which is effective against Apicomplexan parasites in the genus Plasmodium. The genus contains over 200 species and includes those responsible for malaria.

ChEBI Ontology
Outgoing	asperentin (CHEBI:68792) has role Aspergillus metabolite (CHEBI:76956) asperentin (CHEBI:68792) has role Chaetomium metabolite (CHEBI:76960) asperentin (CHEBI:68792) has role antifungal agent (CHEBI:35718) asperentin (CHEBI:68792) has role antiplasmodial drug (CHEBI:64915) asperentin (CHEBI:68792) is a isocoumarins (CHEBI:38758) asperentin (CHEBI:68792) is a pyrans (CHEBI:26407) asperentin (CHEBI:68792) is a resorcinols (CHEBI:33572)

Incoming	5ʼ-hydroxy-asperentin-8-O-methylether (CHEBI:68702) has functional parent asperentin (CHEBI:68792) 5ʼ-hydroxyasperentin (CHEBI:68704) has functional parent asperentin (CHEBI:68792) asperentin-8-methyl ether (CHEBI:68703) has functional parent asperentin (CHEBI:68792)

IUPAC Name

6,8-dihydroxy-3-{[(2R,6S)-6-methyltetrahydro-2H-pyran-2-yl]methyl}-3,4-dihydro-1H-isochromen-1-one

Synonyms	Sources
3,4-dihydro-6,8-dihydroxy-3-(tetrahydro-6-methyl-H-pyran-2-yl)methylisocoumarin	ChemIDplus
cladosporin	ChemIDplus

Last Modified

13 January 2014