Mabetaarilactone A (CHEBI:202216)

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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	Mabetaarilactone A

ChEBI ID	CHEBI:202216

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C11H14O5

Net Charge

Average Mass

226.228

Monoisotopic Mass

226.08412

InChI

InChI=1S/C11H14O5/c1-4-7-3-6(12)8(13)11(4)9(16-7)5(2)15-10(11)14/h4,6-9,12-13H,2-3H2,1H3/t4-,6+,7-,8+,9-,11+/m1/s1

InChIKey

WEYVNBPVWCXGFX-PINFBOFISA-N

SMILES

O=C1OC(=C)[C@@H]2[C@]13[C@@H](O)[C@@H](O)C[C@H]([C@H]3C)O2

Metabolite of Species	Details
Massarina (NCBI:txid45292)	See: DOI

ChEBI Ontology
Outgoing	Mabetaarilactone A (CHEBI:202216) is a furofuran (CHEBI:47790)

IUPAC Name

(1S,5S,7R,9S,10R,11S)-9,10-dihydroxy-11-methyl-4-methylidene-3,6-dioxatricyclo[5.3.1.01,5]undecan-2-one