Spiroacaciicolide A (CHEBI:202895)

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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	Spiroacaciicolide A

ChEBI ID	CHEBI:202895

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C14H20O4

Net Charge

Average Mass

252.310

Monoisotopic Mass

252.13616

InChI

InChI=1S/C14H20O4/c1-9(15)14(18)7-6-12(2,3)13(14)5-4-10(16)11(17)8-13/h8,17-18H,4-7H2,1-3H3/t13-,14+/m0/s1

InChIKey

FYMHINMBSOOGLD-UONOGXRCSA-N

SMILES

O=C1C(O)=C[C@@]2([C@](O)(C(=O)C)CCC2(C)C)CC1

Metabolite of Species	Details
Pseudolagarobasidium acaciicola (NCBI:txid386453)	See: DOI

ChEBI Ontology
Outgoing	Spiroacaciicolide A (CHEBI:202895) is a cyclohexenones (CHEBI:48953)

IUPAC Name

(4S,5S)-4-acetyl-4,9-dihydroxy-1,1-dimethylspiro[4.5]dec-9-en-8-one