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<compound>
  <id type="integer">353745</id>
  <title nil="true"/>
  <common-name>3-[(2e,5e)-2-[[5-[[3,5-bis(ethenyl)-4-methyl-2h-pyrrol-2-yl]methyl]-3-(2-carboxyethyl)-4-methyl-1h-pyrrol-2-yl]methylidene]-5-[(4-ethenyl-3-methyl-1h-pyrrol-2-yl)methylidene]-4-methylpyrrol-3-yl]propanoic acid</common-name>
  <description>3-[(2e,5e)-2-[[5-[[3,5-bis(ethenyl)-4-methyl-2h-pyrrol-2-yl]methyl]-3-(2-carboxyethyl)-4-methyl-1h-pyrrol-2-yl]methylidene]-5-[(4-ethenyl-3-methyl-1h-pyrrol-2-yl)methylidene]-4-methylpyrrol-3-yl]propanoic acid is a compound with the formula C35H40N4O4. With an average molecular weight of 580.70 g/mol, 3-[(2e,5e)-2-[[5-[[3,5-bis(ethenyl)-4-methyl-2h-pyrrol-2-yl]methyl]-3-(2-carboxyethyl)-4-methyl-1h-pyrrol-2-yl]methylidene]-5-[(4-ethenyl-3-methyl-1h-pyrrol-2-yl)methylidene]-4-methylpyrrol-3-yl]propanoic acid is a heavy molecule.</description>
  <cas nil="true"/>
  <pubchem-id>126961211</pubchem-id>
  <chemical-formula>C35H40N4O4</chemical-formula>
  <weight>580.7</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">2026-08-31T20:48:19Z</created-at>
  <updated-at type="dateTime">2026-08-31T20:48:19Z</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>CC1=C(NC=C1C=C)C=C2C(=C(C(=CC3=C(C(=C(N3)CC4C(=C(C(=N4)C=C)C)C=C)C)CCC(=O)O)N2)CCC(=O)O)C</moldb-smiles>
  <moldb-formula>C35H40N4O4</moldb-formula>
  <moldb-inchi>InChI=1S/C35H40N4O4/c1-8-23-18-36-28(19(23)4)15-29-21(6)25(11-13-34(40)41)32(38-29)17-33-26(12-14-35(42)43)22(7)30(39-33)16-31-24(9-2)20(5)27(10-3)37-31/h8-10,15,17-18,31,36,38-39H,1-3,11-14,16H2,4-7H3,(H,40,41)(H,42,43)/b29-15+,32-17+</moldb-inchi>
  <moldb-inchikey>JHTJQUVCSJWHQR-OABSBMLDSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">580.3049558</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>4.6</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>CHEM349638</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>3-[(2e,5e)-2-[[5-[[3,5-bis(ethenyl)-4-methyl-2h-pyrrol-2-yl]methyl]-3-(2-carboxyethyl)-4-methyl-1h-pyrrol-2-yl]methylidene]-5-[(4-ethenyl-3-methyl-1h-pyrrol-2-yl)methylidene]-4-methylpyrrol-3-yl]propanoic 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>Organoheterocyclic compounds</superklass>
  <klass>Tetrapyrroles and derivatives</klass>
  <subklass nil="true"/>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0304027</sync-id>
  <structure-inchikey>JHTJQUVCSJWHQR-UHFFFAOYSA-N</structure-inchikey>
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  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
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  <structure-indexed-at type="dateTime">2026-09-19T05:51:32Z</structure-indexed-at>
</compound>
