346055 <common-name>[2-amino-2-oxo-1-(5-phenyltetrazol-1-yl)ethyl]-triphenylphosphanium</common-name> <description>[2-amino-2-oxo-1-(5-phenyltetrazol-1-yl)ethyl]-triphenylphosphanium is a compound with the formula C27H23N5OP+. It has an average molecular weight of 464.50 g/mol.</description> <cas nil="true"/> <pubchem-id>4245707</pubchem-id> <chemical-formula>C27H23N5OP+</chemical-formula> <weight>464.5</weight> <appearance nil="true"/> <melting-point nil="true"/> <boiling-point nil="true"/> <density nil="true"/> <solubility nil="true"/> <specific-gravity nil="true"/> <flash-point nil="true"/> <vapour-pressure nil="true"/> <route-of-exposure nil="true"/> <target nil="true"/> <mechanism-of-toxicity nil="true"/> <metabolism nil="true"/> <toxicity nil="true"/> <lethaldose nil="true"/> <carcinogenicity nil="true"/> <use-source nil="true"/> <min-risk-level nil="true"/> <health-effects nil="true"/> <symptoms nil="true"/> <treatment nil="true"/> <created-at type="dateTime">2026-08-31T09:20:26Z</created-at> <updated-at type="dateTime">2026-08-31T09:20:26Z</updated-at> <interacting-proteins nil="true"/> <wikipedia nil="true"/> <uniprot-id nil="true"/> <kegg-compound-id nil="true"/> <omim-id nil="true"/> <chebi-id nil="true"/> <biocyc-id nil="true"/> <ctd-id nil="true"/> <stitch-id nil="true"/> <drugbank-id nil="true"/> <pdb-id nil="true"/> <actor-id nil="true"/> <organism nil="true"/> <export type="boolean">true</export> <metabolizing-proteins nil="true"/> <transporting-proteins nil="true"/> <moldb-smiles>C1=CC=C(C=C1)C2=NN=NN2C(C(=O)N)[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5</moldb-smiles> <moldb-formula>C27H23N5OP+</moldb-formula> <moldb-inchi>InChI=1S/C27H22N5OP/c28-25(33)27(32-26(29-30-31-32)21-13-5-1-6-14-21)34(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20,27H,(H-,28,33)/p+1</moldb-inchi> <moldb-inchikey>TWUDVKGAYBKKEB-UHFFFAOYSA-O</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">464.1640224</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>4.8</logp> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id nil="true"/> <structure-image-file-name nil="true"/> <structure-image-content-type nil="true"/> <structure-image-file-size type="integer" nil="true"/> <structure-image-updated-at type="dateTime" nil="true"/> <biodb-id nil="true"/> <synthesis-reference nil="true"/> <structure-image-caption nil="true"/> <chemdb-id>CHEM341948</chemdb-id> <dsstox-id nil="true"/> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id nil="true"/> <iupac>[2-amino-2-oxo-1-(5-phenyltetrazol-1-yl)ethyl]-triphenylphosphanium</iupac> <moldb-polar-surface-area nil="true"/> <moldb-refractivity nil="true"/> <moldb-polarizability nil="true"/> <moldb-rotatable-bond-count nil="true"/> <moldb-acceptor-count nil="true"/> <moldb-donor-count nil="true"/> <moldb-pka-strongest-acidic nil="true"/> <moldb-pka-strongest-basic nil="true"/> <moldb-physiological-charge nil="true"/> <moldb-number-of-rings nil="true"/> <moldb-alogps-logp nil="true"/> <moldb-alogps-logs nil="true"/> <moldb-alogps-solubility nil="true"/> <kingdom>Organic compounds</kingdom> <superklass>Benzenoids</superklass> <klass>Benzene and substituted derivatives</klass> <subklass>Phenylphosphines and derivatives</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0296409</sync-id> <structure-inchikey>TWUDVKGAYBKKEB-UHFFFAOYSA-O</structure-inchikey> <structure-fingerprint>40000000000000000000000000000000000800000000002000000000000000004000000000000000000000000000002004000000000080000000000000200000000000000000000000000000000000000020000000000000000000008000000000000000090000000000000000000000000000000100000000000000000000000000020000040000800000000000000000881000000100080000000001000000000000000000000000000008080000000000000000000001020000200000000000000000000002000200000000000000000000004000002000000200000001000000000000000000000044000000000400000000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAiAAAAJgAAAIABBkBoAAAAAwMBBkBoAAAA AwMBBkBoAAAAAwMBBkAoAAAAAwQGQGgAAAADAwEGQGgAAAADAwEGQCgAAAAD BAdAKAAAAAMDB0AoAAAAAwMHQCgAAAADAwdAKAAAAAMDBgBgAAAAAwEGACgA AAADBAgAKAAAAAMCBwBoAAAAAwECDyAiAAAAAQQGQCgAAAADBAZAaAAAAAMD AQZAaAAAAAMDAQZAaAAAAAMDAQZAaAAAAAMDAQZAaAAAAAMDAQZAKAAAAAME BkBoAAAAAwMBBkBoAAAAAwMBBkBoAAAAAwMBBkBoAAAAAwMBBkBoAAAAAwMB BkAoAAAAAwQGQGgAAAADAwEGQGgAAAADAwEGQGgAAAADAwEGQGgAAAADAwEG QGgAAAADAwELAAFoDAECaAwCA2gMAwRoDAQFaAwDBiAGB2gMBwhoDAgJaAwJ CmgMCgsACwwADA0oAgwOIAsPAA8QABARaAwREmgMEhNoDBMUaAwUFWgMDxYA FhdoDBcYaAwYGWgMGRpoDBobaAwPHAAcHWgMHR5oDB4faAwfIGgMICFoDAUA aAwKBmgMFRBoDBsWaAwhHGgMQgUAAAAGAAUEAwIBBQcGCgkIBhESExQVEAYX GBkaGxYGHR4fICEcFwQAAAAAAAAAFg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:44:54Z</structure-indexed-at> </compound>