Pregeijerene (CHEBI:191546)

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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	Pregeijerene

ChEBI ID	CHEBI:191546

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C12H18

Net Charge

Average Mass

162.276

Monoisotopic Mass

162.14085

InChI

InChI=1S/C12H18/c1-11-7-4-3-5-8-12(2)10-6-9-11/h3-4,7,10H,5-6,8-9H2,1-2H3/b4-3-,11-7-,12-10-

InChIKey

ACTKFDMFHYIKRY-MBDGBGPPSA-N

SMILES

C1CC(=CC=CCCC(=C1)C)C

Metabolite of Species	Details
Ulmus parvifolia (NCBI:txid63058)	Found in bark (BTO:0001301). See: MetaboLights Study
Ulmus parvifolia (NCBI:txid63058)	Found in seed (BTO:0001226). See: MetaboLights Study

ChEBI Ontology
Outgoing	Pregeijerene (CHEBI:191546) is a hydrocarbon (CHEBI:24632)

IUPAC Name

(1Z,3Z,7Z)-1,7-dimethylcyclodeca-1,3,7-triene