345502 <common-name>Methyl (2s)-2-[(2-hexyl-3-oxodecanoyl)amino]-3-(4-hydroxyphenyl)propanoate</common-name> <description>Methyl (2s)-2-[(2-hexyl-3-oxodecanoyl)amino]-3-(4-hydroxyphenyl)propanoate is a chemical compound with the formula C26H41NO5. It has an average molecular weight of 447.60 g/mol.</description> <cas>943454-45-3</cas> <pubchem-id>71587881</pubchem-id> <chemical-formula>C26H41NO5</chemical-formula> <weight>447.6</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">2026-08-31T08:17:47Z</created-at> <updated-at type="dateTime">2026-08-31T08:17:47Z</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>CCCCCCCC(=O)C(CCCCCC)C(=O)NC(CC1=CC=C(C=C1)O)C(=O)OC</moldb-smiles> <moldb-formula>C26H41NO5</moldb-formula> <moldb-inchi>InChI=1S/C26H41NO5/c1-4-6-8-10-12-14-24(29)22(13-11-9-7-5-2)25(30)27-23(26(31)32-3)19-20-15-17-21(28)18-16-20/h15-18,22-23,28H,4-14,19H2,1-3H3,(H,27,30)/t22?,23-/m0/s1</moldb-inchi> <moldb-inchikey>YGFLLOSFSIJBJL-WCSIJFPASA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">447.2984734</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>7</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>CHEM341395</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>Methyl (2s)-2-[(2-hexyl-3-oxodecanoyl)amino]-3-(4-hydroxyphenyl)propanoate</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>CED0295859</sync-id> <structure-inchikey>YGFLLOSFSIJBJL-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000001000002000001900000000400000010000000010000000000000000000000000002000200000000000000000000000000000000000000000000000000000000000000000400010000000000000020000000000100000000009040000000000020010000000040004000000000000000000000000000000000000000000000000040000000000000000000010080200000000000000000000000001000100000004000000000000000080040080000000008002000000000000000000200000008000000002000000000000000000000000000000000000220000020000000000000080000000040000000010400000000000000000000020080000000</structure-fingerprint> 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