(+)-microdiplodiasone (CHEBI:68284)

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CHEBI:68284 - (+)-microdiplodiasone

ChEBI ID	CHEBI:68284
ChEBI Name	(+)-microdiplodiasone
Stars
Definition	An organic heterobicyclic compound that is 2,3-dihydro-4H-chromen-4-one substituted by hydroxy groups at positions 5 and 7, a methyl group at position 2 and a 5-oxotetrahydrofuran-2-yl group at position 2. Isolated from the endophytic fungus Microdiplodia species, it exhibits antibacterial activity.
Last Modified	23 August 2013
Downloads	Molfile

Formula	C14H14O6
Net Charge	0
Average Mass	278.260
Monoisotopic Mass	278.07904
SMILES	[H][C@]1([C@@]2(C)CC(=O)c3c(O)cc(O)cc3O2)CCC(=O)O1
InChI	InChI=1S/C14H14O6/c1-14(11-2-3-12(18)19-11)6-9(17)13-8(16)4-7(15)5-10(13)20-14/h4-5,11,15-16H,2-3,6H2,1H3/t11-,14-/m1/s1
InChIKey	KYUNATJAFQPBJE-BXUZGUMPSA-N

Species of Metabolite	Component	Source	Comments
Microdiplodia (ncbitaxon:371130)	-	PubMed (21244021)	EtOAc extract of an endophytic fungi isolated from Lycium intricatum Strain: 9907

Roles Classification

Biological Roles:

metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.

antibacterial agent A substance (or active part thereof) that kills or slows the growth of bacteria.

ChEBI Ontology

Outgoing Relation(s)
	(+)-microdiplodiasone (CHEBI:68284) has role antibacterial agent (CHEBI:33282)
	(+)-microdiplodiasone (CHEBI:68284) has role metabolite (CHEBI:25212)
	(+)-microdiplodiasone (CHEBI:68284) is a butan-4-olide (CHEBI:22950)
	(+)-microdiplodiasone (CHEBI:68284) is a chromanone (CHEBI:38763)
	(+)-microdiplodiasone (CHEBI:68284) is a organic heterobicyclic compound (CHEBI:27171)
	(+)-microdiplodiasone (CHEBI:68284) is a resorcinols (CHEBI:33572)

IUPAC Name
(2R)-5,7-dihydroxy-2-methyl-2-[(2R)-5-oxotetrahydrofuran-2-yl]-2,3-dihydro-4H-chromen-4-one

Citations