84949 <common-name>Estradiol diundecanoate</common-name> <description>Estradiol diundecanoate belongs to the steroid esters, a subclass of steroids and steroid derivatives within the organic compounds. It is categorized under the superclass of lipids and lipid-like molecules and has the formula C40H64O4. With an average molecular weight of 608.95 g/mol, Estradiol diundecanoate is a heavy molecule.</description> <cas>1263-57-6</cas> <pubchem-id>66422</pubchem-id> <chemical-formula>C40H64O4</chemical-formula> <weight nil="true"/> <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">2026-04-04T20:13:23Z</created-at> <updated-at type="dateTime">2026-04-04T20:13:23Z</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>[H][C@@]1(CC[C@@]2([H])[C@]3([H])CCC4=CC(OC(=O)CCCCCCCCCC)=CC=C4[C@@]3([H])CC[C@]12C)OC(=O)CCCCCCCCCC</moldb-smiles> <moldb-formula>C40H64O4</moldb-formula> <moldb-inchi>InChI=1/C40H64O4/c1-4-6-8-10-12-14-16-18-20-38(41)43-32-23-25-33-31(30-32)22-24-35-34(33)28-29-40(3)36(35)26-27-37(40)44-39(42)21-19-17-15-13-11-9-7-5-2/h23,25,30,34-37H,4-22,24,26-29H2,1-3H3</moldb-inchi> <moldb-inchikey>PWQIMJUJIMPDSQ-OBRFQGJBSA-N</moldb-inchikey> <moldb-average-mass type="decimal">608.948</moldb-average-mass> <moldb-mono-mass type="decimal">608.4804605</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp nil="true"/> <hmdb-id nil="true"/> <chembl-id 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<moldb-alogps-solubility nil="true"/> <kingdom>Organic compounds</kingdom> <superklass>Lipids and lipid-like molecules</superklass> <klass>Steroids and steroid derivatives</klass> <subklass>Steroid esters</subklass> <paper-count type="integer">0</paper-count> <sync-id>CED0172172</sync-id> <structure-inchikey>PWQIMJUJIMPDSQ-OBRFQGJBSA-N</structure-inchikey> <structure-fingerprint>8000004000000000000000000000000000000000004000000000020000002000000000000000000000800000000001000000000000000100000000102000000100000002000000200000002001000042000000000000000000200100010000000000001000000000000200000000000000000000041010030000480040000000000002000300002000000000002000000800000010200000000040040000000000000820010000000000080000000c0000000000000000000008040000000000400000000008000000000000000040200200000000020000000000000000000040000000010400000001000000000000000000000000</structure-fingerprint> 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