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CHEBI:37519 - cyclohepta-1,3,5-triene

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ChEBI Name cyclohepta-1,3,5-triene
ChEBI ID CHEBI:37519
Definition A cycloheptatriene with unsaturation at positions 1, 3 and 5.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C7H8
Net Charge 0
Average Mass 92.13842
Monoisotopic Mass 92.063
InChI InChI=1S/C7H8/c1-2-4-6-7-5-3-1/h1-6H,7H2
InChIKey CHVJITGCYZJHLR-UHFFFAOYSA-N
SMILES C1C=CC=CC=C1
ChEBI Ontology
Outgoing cyclohepta-1,3,5-triene (CHEBI:37519) is a annulene (CHEBI:33662)
cyclohepta-1,3,5-triene (CHEBI:37519) is a cycloheptatriene (CHEBI:51732)
Incoming β-thujaplicin (CHEBI:10447) has parent hydride cyclohepta-1,3,5-triene (CHEBI:37519)
cyclohepta-2,4,6-trienylium (CHEBI:48079) has parent hydride cyclohepta-1,3,5-triene (CHEBI:37519)
stipitatic acid (CHEBI:15957) has parent hydride cyclohepta-1,3,5-triene (CHEBI:37519)
cyclohepta-2,4,6-trienyl group (CHEBI:51728) is substituent group from cyclohepta-1,3,5-triene (CHEBI:37519)
IUPAC Name
cyclohepta-1,3,5-triene
Synonyms Sources
1,3,5-cycloheptatriene NIST Chemistry WebBook
1H-[7]annulene IUPAC
Cycloheptatrien ChEBI
cycloheptatriene ChemIDplus
tropilidene ChemIDplus
tropilidine ChemIDplus
Tropyliden ChEBI
Zykloheptatrien ChEBI
Database Links Databases
Cycloheptatriene Wikipedia
WO2011123198 Patent
View more database links
Registry Numbers Types Sources
1943 Gmelin Registry Number Gmelin
506066 Beilstein Registry Number Beilstein
506066 Reaxys Registry Number Reaxys
544-25-2 CAS Registry Number NIST Chemistry WebBook
544-25-2 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
23764564 PubMed citation Europe PMC
24011338 PubMed citation Europe PMC
Last Modified
10 March 2014