Norbotrydialone acetate (CHEBI:214661)

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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	Norbotrydialone acetate

ChEBI ID	CHEBI:214661

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

Submitter	MetaboLights

Supplier Information

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Formula

C16H22O4

Net Charge

Average Mass

278.348

Monoisotopic Mass

278.15181

InChI

InChI=1S/C16H22O4/c1-8-6-10(19-9(2)17)12-13-11(8)14(18)20-16(13,5)7-15(12,3)4/h8,10,12H,6-7H2,1-5H3/t8-,10+,12-,16-/m1/s1

InChIKey

OMZUEHMZFLBHNI-PCKWUFTNSA-N

SMILES

O=C1O[C@@]2(CC(C)(C)[C@H]3C2=C1[C@@H](C[C@@H]3OC(=O)C)C)C

Metabolite of Species	Details
Botrytis cinerea (NCBI:txid40559)	See: PubMed

ChEBI Ontology
Outgoing	Norbotrydialone acetate (CHEBI:214661) is a butenolide (CHEBI:50523)

IUPAC Name

[(4R,7S,8S,10R)-4,6,6,10-tetramethyl-2-oxo-3-oxatricyclo[5.3.1.04,11]undec-1(11)-en-8-yl] acetate