298328 <common-name>1,3,7-trimethyl-8-(3-methylcyclohexyl)oxypurine-2,6-dione</common-name> <description nil="true"/> <cas nil="true"/> <pubchem-id>52357</pubchem-id> <chemical-formula>C15H22N4O3</chemical-formula> <weight>306.36</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">2026-08-28T14:42:39Z</created-at> <updated-at type="dateTime">2026-08-28T14:42:39Z</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>CC1CCCC(C1)OC2=NC3=C(N2C)C(=O)N(C(=O)N3C)C</moldb-smiles> <moldb-formula>C15H22N4O3</moldb-formula> <moldb-inchi>InChI=1S/C15H22N4O3/c1-9-6-5-7-10(8-9)22-14-16-12-11(17(14)2)13(20)19(4)15(21)18(12)3/h9-10H,5-8H2,1-4H3</moldb-inchi> <moldb-inchikey>IIVPOHXPTVEOOE-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">306.1691906</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>2.1</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>CHEM294221</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>1,3,7-trimethyl-8-(3-methylcyclohexyl)oxypurine-2,6-dione</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>Organoheterocyclic compounds</superklass> <klass>Imidazopyrimidines</klass> <subklass>Purines and purine derivatives</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0249681</sync-id> <structure-inchikey>IIVPOHXPTVEOOE-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>100000000000000000000000000000000000000000000000020000000000000002000008000000000000000000000400480000800000400080000000000000000000020000000000100000000000000000010000000000000000000000000000000000000020100000000000080000000108800000041000000000000000000045800000000000000000000000000200000000800140004000000000000080000008000000080000000000000000000000000000000000000000000000000200000000000008000040000000000000000000000000000002001000000100000000000000000000000040000000000000000</structure-fingerprint> <structure-pattern-fingerprint>503640000512864480000b6401682001001014028195200000376840822009cc443220111b8000000108411804e0001004200024508c320100a6e43100a1c000c7110c0812d054000090104000620200080405f151215a32420405625022d9040c3804270848220160418510cdb40001208680788101e0041198286002510002446c00094ef88208080602648e2c0008391e88d24440160a04201d0020c000a480c310220092c00012000968417d25100ac00003a941084018a066102cd00213a30010a4049007134181140055110ac005410000030050200d0022040a00030091104910088c020000000411d9122084081302309046101e4100110072000002</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`�������`�������`�������`�������`�������`�������`�������(������@(������@(������@(������@(������@(�������`������@(�������(������@(������@(�������(������@(�������`�������`����������������������������� � h� h� �h���h�� ���h���(���h���h���(���h������������h�� h�B������������ ��� ����� �����������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:08:57Z</structure-indexed-at> </compound>