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CHEBI:3573 - Chamazulene

Default Structure
ChEBI IDCHEBI:3573
ChEBI NameChamazulene
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC14H16
Net Charge0
Average Mass184.282
Monoisotopic Mass184.12520
SMILESCCc1ccc(C)c2ccc(C)c-2c1
InChIInChI=1S/C14H16/c1-4-12-7-5-10(2)13-8-6-11(3)14(13)9-12/h5-9H,4H2,1-3H3
InChIKeyGXGJIOMUZAGVEH-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Chamazulene (CHEBI:3573) is a sesquiterpenoid (CHEBI:26658)
Synonym  Source
ChamazuleneKEGG COMPOUND
Manual XrefsDatabases
C00003114KNApSAcK
C09633KEGG COMPOUND
HMDB0036470HMDB
Registry NumbersSources
CAS:529-05-5KEGG COMPOUND