314917 <common-name>Ethyl 2-[3-(dimethylamino)-2-hydroxypropoxy]-6-methyl-3-propan-2-ylbenzoate</common-name> <description nil="true"/> <cas nil="true"/> <pubchem-id>3033052</pubchem-id> <chemical-formula>C18H29NO4</chemical-formula> <weight>323.4</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">2026-08-29T12:06:58Z</created-at> <updated-at type="dateTime">2026-08-29T12:06:58Z</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>CCOC(=O)C1=C(C=CC(=C1OCC(CN(C)C)O)C(C)C)C</moldb-smiles> <moldb-formula>C18H29NO4</moldb-formula> <moldb-inchi>InChI=1S/C18H29NO4/c1-7-22-18(21)16-13(4)8-9-15(12(2)3)17(16)23-11-14(20)10-19(5)6/h8-9,12,14,20H,7,10-11H2,1-6H3</moldb-inchi> <moldb-inchikey>SNFZSVZRZFZVIV-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">323.2096584</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>3</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>CHEM310810</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>Ethyl 2-[3-(dimethylamino)-2-hydroxypropoxy]-6-methyl-3-propan-2-ylbenzoate</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>Lipids and lipid-like molecules</superklass> <klass>Prenol lipids</klass> <subklass>Monoterpenoids</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0265794</sync-id> <structure-inchikey>SNFZSVZRZFZVIV-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000000000002000000800000000240000050000000000000000000100400000000001002000000000400000000000000000000000000000000000000000000000000000000000000200200000000000028200000000100000000006000010000000020250000000000000000004000000000000000000000000000000000000000000040000000000004000000000000100000000000000000020000000000000000080000000000000000080100000000000000080000000000000000000000000000000000000000000000000000000000100000002020000200000008000000000000000000080040000000000400000000000000000000000000000200</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`�������`�������(�������(�������(������@(������@(������@h�������@h�������@(������@(�������(�������`�������`�������`������� ������`�������`�������`�������`�������`�������`�������`�������������� ��(��� ��h���h���h�� h� h� � ���� � ����������� �� ����������� �h�B������ �������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:21:15Z</structure-indexed-at> </compound>