<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">335538</id>
  <title nil="true"/>
  <common-name>3-(9h-fluoren-9-ylmethoxycarbonylamino)bicyclo[2.2.1]heptane-2-carboxylic acid</common-name>
  <description nil="true"/>
  <cas nil="true"/>
  <pubchem-id>22569034</pubchem-id>
  <chemical-formula>C23H23NO4</chemical-formula>
  <weight>377.4</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">2026-08-30T17:43:43Z</created-at>
  <updated-at type="dateTime">2026-08-30T17:43:43Z</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>C1CC2CC1C(C2NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35)C(=O)O</moldb-smiles>
  <moldb-formula>C23H23NO4</moldb-formula>
  <moldb-inchi>InChI=1S/C23H23NO4/c25-22(26)20-13-9-10-14(11-13)21(20)24-23(27)28-12-19-17-7-3-1-5-15(17)16-6-2-4-8-18(16)19/h1-8,13-14,19-21H,9-12H2,(H,24,27)(H,25,26)</moldb-inchi>
  <moldb-inchikey>RAQPAPMBITVVOX-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">377.1627082</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>4.5</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>CHEM331431</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-(9h-fluoren-9-ylmethoxycarbonylamino)bicyclo[2.2.1]heptane-2-carboxylic 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>Benzenoids</superklass>
  <klass>Fluorenes</klass>
  <subklass nil="true"/>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0286009</sync-id>
  <structure-inchikey>RAQPAPMBITVVOX-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>800000000000000012000000000000000000000000000000000000040000000100008004100014000000000000000000000000000000000000000000000000400000000000000020000000000100000000000000100000000000010000000000000000000040000000020000000000000080000000101000000000000000800000000000800080000000000100000000000000000000000840000004000000000000884200000000010000000000000000000000000000000000000000000002000000000000000000000000000000000202000000000080000000000040800050000000000400000000000080000000000000000001</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ�������������������� ���€���`�������`�������`�������`�������`�������`�������`�������h��������(�������(�������(�������`�������`������@(������@h�������@h�������@h�������@h�������@(������@(������@h�������@h�������@h�������@h�������@(�������(�������(�������h������������������������������ �	(��
 
��������h���h���h���h���h��� ��h���h���h���h���h������(��� ����������h���h�B��������������������������������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:37:14Z</structure-indexed-at>
</compound>
