312749 <common-name>[[(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] 2-phenylacetate</common-name> <description>[[(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] 2-phenylacetate is a chemical compound with the formula C18H20N5O8P. It has an average molecular weight of 465.40 g/mol.</description> <cas nil="true"/> <pubchem-id>50909902</pubchem-id> <chemical-formula>C18H20N5O8P</chemical-formula> <weight>465.4</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">2026-08-29T09:26:21Z</created-at> <updated-at type="dateTime">2026-08-29T09:26:21Z</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)CC(=O)OP(=O)(O)OCC2C(C(C(O2)N3C=NC4=C(N=CN=C43)N)O)O</moldb-smiles> <moldb-formula>C18H20N5O8P</moldb-formula> <moldb-inchi>InChI=1S/C18H20N5O8P/c19-16-13-17(21-8-20-16)23(9-22-13)18-15(26)14(25)11(30-18)7-29-32(27,28)31-12(24)6-10-4-2-1-3-5-10/h1-5,8-9,11,14-15,18,25-26H,6-7H2,(H,27,28)(H2,19,20,21)/t11-,14-,15-,18-/m1/s1</moldb-inchi> <moldb-inchikey>VUKDZGAUWUDQRZ-XKLVTHTNSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">465.1049496</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>-1.4</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>CHEM308642</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>[[(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] 2-phenylacetate</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>Nucleosides, nucleotides, and analogues</superklass> <klass>Purine nucleotides</klass> <subklass>Purine ribonucleotides</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0263676</sync-id> <structure-inchikey>VUKDZGAUWUDQRZ-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>80000108000000000000000000100000000a0004000000000000000000000000000040000000000002004000000000000000200000002400000000000000000000040000000200000000020800000000100000000000000000000000000010000000000000100000000000040000900000020000800000100100040000000200000811000000000800001001880000100000000000004400000000000000000000000000001082000000000000000085000000100000000000001000000080000000000000000000000000000008000080800000220000000000000200000020800000042000000000440000000000000000000000000000000</structure-fingerprint> 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AAADAQIIAGAAAAABAQgAYAAAAAEBCwABaAwBAmgMAgNoDAMEaAwEBWgMAwYA BgcABwgoAgcJIAkKAAoLCAIKDAAKDQANDgAODwAPEAAQEQAREgASEwASFAAU FWgMFRZoDBYXaAwXGGgMGBloDBkaaAwaG2gMGxxoDBgdIBEeABAfAAUAaAwT DwAcFGgMHBdoDEIEAAAABgAFBAMCAQUQDxMSEQUVFBwXFgYYGRobHBcXBAAA AAAAAAAW </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:19:39Z</structure-indexed-at> </compound>