CHEBI:172434 - 2,6-Diisopropyl-3-methylphenol

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 2,6-Diisopropyl-3-methylphenol
ChEBI ID CHEBI:172434
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C13H20O
Net Charge 0
Average Mass 192.302
Monoisotopic Mass 192.15142
InChI InChI=1S/C13H20O/c1-8(2)11-7-6-10(5)12(9(3)4)13(11)14/h6-9,14H,1-5H3
InChIKey KEGGEHPMMDYTGB-UHFFFAOYSA-N
SMILES OC=1C(C(C)C)=C(C=CC1C(C)C)C
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in blood plasma (BTO:0000131). See: MetaboLights Study
ChEBI Ontology
Outgoing 2,6-Diisopropyl-3-methylphenol (CHEBI:172434) is a monoterpenoid (CHEBI:25409)
IUPAC Name
3-methyl-2,6-di(propan-2-yl)phenol
Manual Xrefs Databases
107095 ChemSpider
HMDB0029820 HMDB
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Registry Number Type Source
28434-93-7 CAS Registry Number ChemIDplus