CHEBI:37444 - benzo-15-crown-5

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ChEBI Name benzo-15-crown-5 ChEBI ID CHEBI:37444 Definition A crown ether that is 15-crown-5 ortho-fused to a benzene ring. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C14H20O5 Net Charge 0 Average Mass 268.30560 Monoisotopic Mass 268.13107 InChI InChI=1S/C14H20O5/c1-2-4-14-13(3-1)18-11-9-16-7-5-15-6-8-17-10-12-19-14/h1-4H,5-12H2 InChIKey FNEPSTUXZLEUCK-UHFFFAOYSA-N SMILES C1COCCOc2ccccc2OCCOCCO1 ChEBI Ontology Outgoing benzo-15-crown-5 (CHEBI:37444) is a crown ether (CHEBI:37408) IUPAC Name 2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-benzopentaoxacyclopentadecine Synonyms Sources benzo-15-crown-5 IUPAC benzo[6]1,4,7,10,13-pentaoxacyclopentadecane NIST Chemistry WebBook benzyl 15-crown-5 ChemIDplus monobenzo-15-crown-5 NIST Chemistry WebBook Registry Numbers Types Sources 14098-44-3 CAS Registry Number ChemIDplus 14098-44-3 CAS Registry Number NIST Chemistry WebBook 1624106 Reaxys Registry Number Reaxys 5454 Gmelin Registry Number Gmelin Citations Types Sources 11421704 PubMed citation Europe PMC 11457328 PubMed citation Europe PMC 12506363 PubMed citation Europe PMC 15352505 PubMed citation Europe PMC 17690436 PubMed citation Europe PMC 19382582 PubMed citation Europe PMC 24621383 PubMed citation Europe PMC 25248049 PubMed citation Europe PMC 26135940 PubMed citation Europe PMC 27591702 PubMed citation Europe PMC Last Modified 26 April 2021