322396 <common-name>[[(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] (e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate</common-name> <description>[[(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] (e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate is a chemical compound with the formula C20H22N5O10P. With an average molecular weight of 523.40 g/mol, [[(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] (e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate is a heavy molecule.</description> <cas nil="true"/> <pubchem-id>118988610</pubchem-id> <chemical-formula>C20H22N5O10P</chemical-formula> <weight>523.4</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">2026-08-29T22:27:18Z</created-at> <updated-at type="dateTime">2026-08-29T22:27:18Z</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>COC1=C(C=CC(=C1)C=CC(=O)OP(=O)(O)OCC2C(C(C(O2)N3C=NC4=C(N=CN=C43)N)O)O)O</moldb-smiles> <moldb-formula>C20H22N5O10P</moldb-formula> <moldb-inchi>InChI=1S/C20H22N5O10P/c1-32-12-6-10(2-4-11(12)26)3-5-14(27)35-36(30,31)33-7-13-16(28)17(29)20(34-13)25-9-24-15-18(21)22-8-23-19(15)25/h2-6,8-9,13,16-17,20,26,28-29H,7H2,1H3,(H,30,31)(H2,21,22,23)/b5-3+/t13-,16-,17-,20-/m1/s1</moldb-inchi> <moldb-inchikey>PWYOJDOMPJUZED-NLGGRGNSSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">523.1104289</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>-1.2</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>CHEM318289</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] (e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate</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 nil="true"/> <superklass nil="true"/> <klass nil="true"/> <subklass nil="true"/> <paper-count type="integer" nil="true"/> <sync-id>CED0273103</sync-id> <structure-inchikey>PWYOJDOMPJUZED-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>410000080000108000000000000000000000008000a0004000000000400000000000000000000000000000002000000000000000000200000002400000000000000000000040000000220000084020800000000300000000000000000000000000010000001040000100100000000000000900000020000800000000100040000040004000011000000000800000009880000000000000000004400000000000080000000000000001080000000000000000085000100100000000000081000000080000002100000000000000000000008000080800000200000000000000200008020800000042000000000440000000000020000000000000004040</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ����������������$���'���€���`�������(������@(������@(������@h�������@h�������@(������@h��������h��������h��������(�������(�������(������� ������(�������`������� ������`�������`�������`�������`�������`������� �����@(������@h�������@(������@(������@(������@(������@h�������@(������@(�������h��������`�������`�������h������������ ��h���h���h���h���h��� � (� �(� � � � ��� �� �������������������������h���h���h���h���h���h���h���h�� �!��"��# ��h������h���h�B����������������������������������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:26:55Z</structure-indexed-at> </compound>