Vibralactone I (CHEBI:214102)

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

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	Vibralactone I

ChEBI ID	CHEBI:214102

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C12H20O3

Net Charge

Average Mass

212.289

Monoisotopic Mass

212.14124

InChI

InChI=1S/C12H20O3/c1-8(2)3-4-9-5-10(6-13)11(7-14)12(9)15/h3,9-11,13-14H,4-7H2,1-2H3/t9-,10+,11+/m0/s1

InChIKey

RIQBPOOLFXBSPM-HBNTYKKESA-N

SMILES

O=C1[C@@H]([C@@H](CO)C[C@@H]1CC=C(C)C)CO

Metabolite of Species	Details
Boreostereum vibrans (NCBI:txid1826779)	See: PubMed

ChEBI Ontology
Outgoing	Vibralactone I (CHEBI:214102) is a cyclic ketone (CHEBI:3992)

IUPAC Name

(2S,3S,5S)-2,3-bis(hydroxymethyl)-5-(3-methylbut-2-enyl)cyclopentan-1-one