<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">137864</id>
  <title nil="true"/>
  <common-name>TNP-2092</common-name>
  <description>TNP-2092 is a chemical compound with the formula C65H81FN6O15. With an average molecular weight of 1,205 g/mol, TNP-2092 is a heavy molecule. This compound acts as an inhibitor for three specific protein targets: DNA gyrase subunit A (gyrA), DNA gyrase subunit B (gyrB), and DNA topoisomerase 4 subunit A (parC).</description>
  <cas>922717-97-3</cas>
  <pubchem-id nil="true"/>
  <chemical-formula>C65H81FN6O15</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">2026-04-14T20:44:12Z</created-at>
  <updated-at type="dateTime">2026-05-14T19:57:34Z</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>DB16312</drugbank-id>
  <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>CO[C@H]1C=CO[C@@]2(C)OC3=C(C2=O)C2=C(C(O)=C3C)C(O)=C(NC(=O)C(C)=C\C=C/[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@H](C)[C@H](OC(C)=O)[C@H]1C)C(\C=N\N1CCC(CC1)N(C)C1(CC1)[C@@H]1CCN(C1)C1=C(C)C3=C(C=C(C(O)=O)C(=O)N3C=C1F)C1CC1)=C2O</moldb-smiles>
  <moldb-formula>C65H81FN6O15</moldb-formula>
  <moldb-inchi>InChI=1S/C65H81FN6O15/c1-31-13-12-14-32(2)61(80)68-50-44(56(77)47-48(57(50)78)55(76)37(7)59-49(47)60(79)64(9,87-59)85-26-20-46(84-11)33(3)58(86-38(8)73)36(6)54(75)35(5)53(31)74)28-67-71-24-18-41(19-25-71)69(10)65(21-22-65)40-17-23-70(29-40)52-34(4)51-42(39-15-16-39)27-43(63(82)83)62(81)72(51)30-45(52)66/h12-14,20,26-28,30-31,33,35-36,39-41,46,53-54,58,74-78H,15-19,21-25,29H2,1-11H3,(H,68,80)(H,82,83)/b13-12-,26-20-,32-14?,67-28+/t31-,33-,35+,36-,40+,46-,53-,54+,58+,64-/m0/s1</moldb-inchi>
  <moldb-inchikey>OPZFMLLAJBIKAN-JNEXSVMGSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">1205.388</moldb-average-mass>
  <moldb-mono-mass type="decimal">1204.574394095</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>2.38</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>CHEM133757</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>8-[(3R)-3-[1-({1-[(E)-{[(7S,9E,11S,12S,13S,14S,15R,16R,17S,18S,19E)-13-(acetyloxy)-2,15,17,27,29-pentahydroxy-11-methoxy-3,7,12,14,16,18,22-heptamethyl-6,23-dioxo-8,30-dioxa-24-azatetracyclo[23.3.1.1^{4,7}.0^{5,28}]triaconta-1(28),2,4,9,19,21,25(29),26-octaen-26-yl]methylidene}amino]piperidin-4-yl}(methyl)amino)cyclopropyl]pyrrolidin-1-yl]-1-cyclopropyl-7-fluoro-9-methyl-4-oxo-4H-quinolizine-3-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 nil="true"/>
  <superklass nil="true"/>
  <klass nil="true"/>
  <subklass nil="true"/>
  <paper-count type="integer">62</paper-count>
  <sync-id>CED0022040</sync-id>
  <structure-inchikey>OPZFMLLAJBIKAN-IFSRRPHHSA-N</structure-inchikey>
  <structure-fingerprint>1000200000000000200000000000002001040800000808000008004000200081000200200008040001200000000000a28000000000800041800000000a02200220000400020000208800000003101000040010000000000000000140000000400002801048000000400209400000020000000000005010b001004804001080040020020800000030000000000000040000004040002020028004004400008004000008000080000020008000000000810000004000000000400001000000200000002100004400e00800000002200000100000801800080400004000800000014004000000040081000204004000c100800010000014</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ����������������W���`���€���`������� ����� 4��������h��������h��������(������ $�������`�������(������@(������@(�������(�������(������@(������@(������@(�������h�������@(�������`������@(�������h�������@(�������h��������(�������(�������(�������`�������h��������h��������h������� 4��������`������ 4��������`������ 4��������`������ 4��������`������ 4��������`������ 4��������(�������(�������`�������(������ 4��������`������@(�������h��������(�������(�������`�������`�������`�������`�������`������� ������`������� ������`�������`������ 4��������`�������`�������(�������`������@(������@(�������`������@(������@(������@h�������@(�������(�������h��������(������@(�������(������@(������@h�������@(�����	� ������`�������`�������`������@(�������h������������������(��� ����������	 	
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������-(&amp;$" ��������/����������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T04:50:38Z</structure-indexed-at>
</compound>
