44790 <common-name>Pigment and dye</common-name> <description nil="true"/> <cas nil="true"/> <pubchem-id nil="true"/> <chemical-formula>C34H36N2O4</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">2016-06-03T11:09:59Z</created-at> <updated-at type="dateTime">2026-03-26T19:55:03Z</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>CCN(CCC(C)C)C1=CC2=C(C=C1)C(O)(C1=CC=CC=C1C(O)=O)C1=C(O2)C=C(C)C(NC2=CC=CC=C2)=C1</moldb-smiles> <moldb-formula>C34H36N2O4</moldb-formula> <moldb-inchi>InChI=1S/C34H36N2O4/c1-5-36(18-17-22(2)3)25-15-16-28-32(20-25)40-31-19-23(4)30(35-24-11-7-6-8-12-24)21-29(31)34(28,39)27-14-10-9-13-26(27)33(37)38/h6-16,19-22,35,39H,5,17-18H2,1-4H3,(H,37,38)</moldb-inchi> <moldb-inchikey>DPQBTFMVZGXDOO-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">536.672</moldb-average-mass> <moldb-mono-mass type="decimal">536.267507647</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp nil="true"/> <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>CHEM043685</chemdb-id> <dsstox-id nil="true"/> <toxcast-id nil="true"/> <stoff-ident-origin>Howard & Muir 2013</stoff-ident-origin> <stoff-ident-id>SI00003295</stoff-ident-id> <susdat-id>NS00001862</susdat-id> <iupac>2-{6-[ethyl(3-methylbutyl)amino]-9-hydroxy-3-methyl-2-(phenylamino)-9H-xanthen-9-yl}benzoic acid</iupac> </compound>