348583 <common-name>(2r)-6-[(7-acetamido-1,2,3-trimethoxy-9-oxo-6,8-dihydro-5h-benzo[a]heptalen-10-yl)methylamino]-2-aminohexanoic acid</common-name> <description>(2r)-6-[(7-acetamido-1,2,3-trimethoxy-9-oxo-6,8-dihydro-5h-benzo[a]heptalen-10-yl)methylamino]-2-aminohexanoic acid is a chemical compound with the formula C28H37N3O7. With an average molecular weight of 527.60 g/mol, (2r)-6-[(7-acetamido-1,2,3-trimethoxy-9-oxo-6,8-dihydro-5h-benzo[a]heptalen-10-yl)methylamino]-2-aminohexanoic acid is a heavy molecule.</description> <cas>77096-41-4</cas> <pubchem-id>53581</pubchem-id> <chemical-formula>C28H37N3O7</chemical-formula> <weight>527.6</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">2026-08-31T12:39:16Z</created-at> <updated-at type="dateTime">2026-08-31T12:39:16Z</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>CC(=O)NC1=C2CC(=O)C(=CC=C2C3=C(C(=C(C=C3CC1)OC)OC)OC)CNCCCCC(C(=O)O)N</moldb-smiles> <moldb-formula>C28H37N3O7</moldb-formula> <moldb-inchi>InChI=1S/C28H37N3O7/c1-16(32)31-22-11-9-17-13-24(36-2)26(37-3)27(38-4)25(17)19-10-8-18(23(33)14-20(19)22)15-30-12-6-5-7-21(29)28(34)35/h8,10,13,21,30H,5-7,9,11-12,14-15,29H2,1-4H3,(H,31,32)(H,34,35)/t21-/m1/s1</moldb-inchi> <moldb-inchikey>NRUWROYMQPJMPZ-OAQYLSRUSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">527.2631505</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>-0.9</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>CHEM344476</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>(2r)-6-[(7-acetamido-1,2,3-trimethoxy-9-oxo-6,8-dihydro-5h-benzo[a]heptalen-10-yl)methylamino]-2-aminohexanoic acid</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>CED0298913</sync-id> <structure-inchikey>NRUWROYMQPJMPZ-UHFFFAOYSA-N</structure-inchikey> 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