8alpha-acetoxymultiplolide A (CHEBI:223184)

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CHEBI:223184 - 8alpha-acetoxymultiplolide A

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ChEBI ID	CHEBI:223184
ChEBI Name	8alpha-acetoxymultiplolide A
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C12H16O6
Net Charge	0
Average Mass	256.254
Monoisotopic Mass	256.09469
SMILES	CC(=O)O[C@@H]1C[C@@H](C)OC(=O)[C@H]2O[C@H]2/C=C/[C@@H]1O
InChI	InChI=1S/C12H16O6/c1-6-5-10(17-7(2)13)8(14)3-4-9-11(18-9)12(15)16-6/h3-4,6,8-11,14H,5H2,1-2H3/b4-3+/t6-,8+,9+,10-,11+/m1/s1
InChIKey	GITGKBOJRJGOIP-GGFJVNIXSA-N

Species of Metabolite	Component	Source	Comments
Phomopsisspecies (ncbitaxon:1715245)	-	PubMed (18336005)

Roles Classification

Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base).

ChEBI Ontology

Outgoing Relation(s)
	8alpha-acetoxymultiplolide A (CHEBI:223184) is a dicarboxylic acid (CHEBI:35692)

IUPAC Name
[(1S,4R,6R,7S,8E,10S)-7-hydroxy-4-methyl-2-oxo-3,11-dioxabicyclo[8.1.0]undec-8-en-6-yl] acetate

Manual Xrefs	Databases
21194954	ChemSpider