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CHEBI:88799 - (E)-Calamene

ChEBI IDCHEBI:88799
ChEBI Name(E)-Calamene
Stars
DownloadsMolfile
FormulaC15H22
Net Charge0
Average Mass202.341
Monoisotopic Mass202.17215
SMILESCc1ccc2c(c1)C(C(C)C)CCC2C
InChIInChI=1S/C15H22/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h5,7,9-10,12-13H,6,8H2,1-4H3
InChIKeyPGTJIOWQJWHTJJ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) urine (BTO:0001419) PubMed (24023812)
ChEBI Ontology
Outgoing Relation(s)
(E)-Calamene (CHEBI:88799) is a sesquiterpene (CHEBI:35189)
Synonyms  Source
1,6-dimethyl-4-isopropyltetralinHMDB
1,6-dimethyl-4-propan-2-yl-1,2,3,4-tetrahydronaphthaleneHMDB
1,6-dimethyl-4-(propan-2-yl)-1,2,3,4-tetrahydronaphthaleneHMDB
Manual XrefsDatabases
HMDB0059910HMDB
Registry NumbersSources
CAS:1406-50-4KEGG COMPOUND
Citations