CHEBI:188520 - Triptycene

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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 Triptycene
ChEBI ID CHEBI:188520
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C20H14
Net Charge 0
Average Mass 254.332
Monoisotopic Mass 254.10955
InChI InChI=1S/C20H14/c1-2-8-14-13(7-1)19-15-9-3-5-11-17(15)20(14)18-12-6-4-10-16(18)19/h1-12,19-20H
InChIKey NGDCLPXRKSWRPY-UHFFFAOYSA-N
SMILES C12C=3C(C(C=4C1=CC=CC4)C=5C2=CC=CC5)=CC=CC3
Metabolite of Species Details
Phyllostachys violascens (NCBI:txid1903417) Found in stem (BTO:0001300). of strain Phyllostachys violascens cv. Viridisulcata See: MetaboLights Study
ChEBI Ontology
Outgoing Triptycene (CHEBI:188520) is a anthracenes (CHEBI:46955)
IUPAC Name
pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2,4,6,9,11,13,15,17,19-nonaene
Manual Xref Database
83742 ChemSpider
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Registry Number Type Source
477-75-8 CAS Registry Number ChemIDplus