340839 <common-name>Diethyl (2s)-2-(hexadecanoylamino)butanedioate</common-name> <description>Diethyl (2s)-2-(hexadecanoylamino)butanedioate is a chemical compound with the formula C24H45NO5. It has an average molecular weight of 427.60 g/mol.</description> <cas>3397-14-6</cas> <pubchem-id>57508456</pubchem-id> <chemical-formula>C24H45NO5</chemical-formula> <weight>427.6</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">2026-08-31T00:42:46Z</created-at> <updated-at type="dateTime">2026-08-31T00:42:46Z</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>CCCCCCCCCCCCCCCC(=O)NC(CC(=O)OCC)C(=O)OCC</moldb-smiles> <moldb-formula>C24H45NO5</moldb-formula> <moldb-inchi>InChI=1S/C24H45NO5/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-22(26)25-21(24(28)30-6-3)20-23(27)29-5-2/h21H,4-20H2,1-3H3,(H,25,26)/t21-/m0/s1</moldb-inchi> <moldb-inchikey>HQXMTDSLKXAPTA-NRFANRHFSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">427.3297735</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>7.4</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>CHEM336732</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>Diethyl (2s)-2-(hexadecanoylamino)butanedioate</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>Organic acids and derivatives</superklass> <klass>Carboxylic acids and derivatives</klass> <subklass>Amino acids, peptides, and analogues</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0291241</sync-id> <structure-inchikey>HQXMTDSLKXAPTA-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000000004000000000800000000400000010000000000000000000000000000000000002000000000000000000000000000000000000000000000000000000000000000000000000010000000000000020000000000100000000008000000000000020010000000000000000100001000000000000000000000000000000000000000040000000000000004000010080000000000000000000020000001000002000000000004000000000002000000000000008000000000000000000000000000008040000000000000000000000000000000000032000000000000000000000002000000000000000000000010400000000000000000000000000004000</structure-fingerprint> <structure-pattern-fingerprint>4000002005120e0009000100010820000000000000052000003000400200080c4002005000800000000041000080000004600084808c10010200643000a00000c6110400008000004080102000720100000400004001003240000422000009000c200120004002000000100055340000200080500105e0043118020002100002104400180ee0800808020250882c0008111c0812444014021004080000408000004310000010c00000000940056c25104ac00200880108001000081000400200000000840440002200800204004102900000000002004000090000000801020000000800000000001040000040022000005000308042002c0000008050400006</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������(�������(�������h��������`�������`�������(�������(�������(�������`�������`�������(�������(�������(�������`�������`������������������������������� � � ������ � �������(��� �����������(��� �����������(��� ������B��������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:40:57Z</structure-indexed-at> </compound>