CHEBI:168289 - Rhubafuran

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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 Rhubafuran
ChEBI ID CHEBI:168289
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C12H16O
Net Charge 0
Average Mass 176.259
Monoisotopic Mass 176.12012
InChI InChI=1S/C12H16O/c1-10-8-12(2,9-13-10)11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3
InChIKey GPMLJOOQCIHFET-UHFFFAOYSA-N
SMILES O1C(CC(C1)(C2=CC=CC=C2)C)C
Metabolite of Species Details
Malus domestica (NCBI:txid3750) Found in exocarp (BTO:0000733). of strain Malus x domestica Borkh. cv. Ruixue See: MetaboLights Study
ChEBI Ontology
Outgoing Rhubafuran (CHEBI:168289) is a benzenes (CHEBI:22712)
IUPAC Name
2,4-dimethyl-4-phenyloxolane
Manual Xrefs Databases
101722 ChemSpider
HMDB0036021 HMDB
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Registry Number Type Source
82461-14-1 CAS Registry Number ChemIDplus