<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">360298</id>
  <title nil="true"/>
  <common-name>3-[12-[1-[1-[13,17-bis(2-carboxyethyl)-7-(1-hydroxyethyl)-3,8,12,18-tetramethyl-21,22-dihydroporphyrin-2-yl]ethoxy]ethyl]-18-(2-carboxyethyl)-7-(1-hydroxyethyl)-3,8,13,17-tetramethyl-21,22-dihydroporphyrin-2-yl]propanoic acid</common-name>
  <description nil="true"/>
  <cas nil="true"/>
  <pubchem-id>135577896</pubchem-id>
  <chemical-formula>C68H74N8O11</chemical-formula>
  <weight>1179.4</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">2026-09-01T08:42:24Z</created-at>
  <updated-at type="dateTime">2026-09-01T08:42:24Z</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(C2=CC3=NC(=CC4=NC(=CC5=C(C(=C(N5)C=C1N2)C(C)O)C)C(=C4C)C(C)OC(C)C6=C(C7=CC8=C(C(=C(N8)C=C9C(=C(C(=N9)C=C1C(=C(C(=N1)C=C6N7)C)CCC(=O)O)CCC(=O)O)C)C)C(C)O)C)C(=C3CCC(=O)O)C)CCC(=O)O</moldb-smiles>
  <moldb-formula>C68H74N8O11</moldb-formula>
  <moldb-inchi>InChI=1S/C68H74N8O11/c1-29-41(13-17-61(79)80)53-28-56-44(16-20-64(85)86)32(4)48(72-56)24-59-68(36(8)52(76-59)25-58-65(37(9)77)33(5)49(73-58)21-45(29)69-53)40(12)87-39(11)67-35(7)50-22-46-30(2)42(14-18-62(81)82)54(70-46)27-55-43(15-19-63(83)84)31(3)47(71-55)23-57-66(38(10)78)34(6)51(74-57)26-60(67)75-50/h21-28,37-40,71,73-74,76-78H,13-20H2,1-12H3,(H,79,80)(H,81,82)(H,83,84)(H,85,86)</moldb-inchi>
  <moldb-inchikey>AMYWSBYLSVHSHG-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">1178.547705</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>5.2</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>CHEM356191</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-[12-[1-[1-[13,17-bis(2-carboxyethyl)-7-(1-hydroxyethyl)-3,8,12,18-tetramethyl-21,22-dihydroporphyrin-2-yl]ethoxy]ethyl]-18-(2-carboxyethyl)-7-(1-hydroxyethyl)-3,8,13,17-tetramethyl-21,22-dihydroporphyrin-2-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>Porphyrins</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0310474</sync-id>
  <structure-inchikey>AMYWSBYLSVHSHG-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40000000000000000000800000000104000000000000000000200000900000080000001000000000000000000000002004000000000000000000000001000004000000000000200020010000000000000020000000004100000000000000008000000000010000000000204000100000000100000000001000000800000000000000000040000000040000300000000000000000000000000000001100400000010000000000008000800001080000000000000800000002000000000000000000000008000000000000002000000000000000020000002002404000000000000a40020000000001000040000020200400000000000000000000000000002008</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ����������������W���`���€���`������@(������@(������@(������@h�������@(������@(������@(������@h�������@(������@(������@(������@h�������@(������@(������@(������@(������@8�������@h�������@(������@8��������`�������`�������`�������`�������(�������(�������`�������`�������`������� ������`�������`������@(������@(������@(������@h�������@(������@(������@(������@(������@8�������@h�������@(�������(�������(������@(������@(������@h�������@(�������(�������(������@(������@(������@h�������@(������@8��������`�������`�������`�������(�������(�������h��������`�������`�������(�������(�������h��������`�������`�������`�������`�������`�������`�������(�������(�������`�������`�������(�������(�������h��������`�������`�������`�������(�������(�������h������������h���h���h���h���h���h���h��	h�	
h�
�h���h��h��h���h���h���h���h���h���h��������������� ��(����������������� ��!�!"h�"#h�#$h�$%h�%&amp;h�&amp;'h�'(h�()h�(*h�*+h�+, ,-(�-. ./h�.0h�01h�12 23(�34 45h�46h�67h�78h�39�2:�:;�;&lt;�&lt;=(�&lt;&gt; -?�?@�@A�AB(�AC ,D�'E�&amp;F�FG�FH�"I��J JK(�KL�LM�MN�NO(�NP JQ��R�RS�ST�TU(�TV ��h�51h���h�K� �	 �h�7!h�8#h�)%h�/+h�B
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	���������"!78#�$%)(*+/.0154678#�&amp;%)('�,+/.-�21543����������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:57:46Z</structure-indexed-at>
</compound>
