<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">132088</id>
  <title nil="true"/>
  <common-name>Peforelin</common-name>
  <description>Peforelin belongs to the polypeptides, a class of organic polymers within the organic compounds. It has the chemical formula C59H75N19O13. With an average molecular weight of 1,258 g/mol, Peforelin is a heavy molecule.</description>
  <cas>147859-97-0</cas>
  <pubchem-id>56841717</pubchem-id>
  <chemical-formula>C59H75N19O13</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">2026-04-06T17:00:21Z</created-at>
  <updated-at type="dateTime">2026-05-14T20:43:50Z</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>DB21255</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>NCCCC[C@H](NC(=O)[C@H](CC1=CNC2=CC=CC=C12)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC1=CNC=N1)NC(=O)[C@H](CO)NC(=O)[C@H](CC1=CNC2=CC=CC=C12)NC(=O)[C@H](CC1=CNC=N1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O</moldb-smiles>
  <moldb-formula>C59H75N19O13</moldb-formula>
  <moldb-inchi>InChI=1S/C59H75N19O13/c60-16-6-5-12-40(59(91)78-17-7-13-47(78)58(90)65-27-49(62)81)71-52(84)41(20-33-18-31-8-1-3-10-37(31)68-33)74-56(88)45(24-48(61)80)76-54(86)44(23-36-26-64-30-67-36)75-57(89)46(28-79)77-55(87)42(21-34-19-32-9-2-4-11-38(32)69-34)73-53(85)43(22-35-25-63-29-66-35)72-51(83)39-14-15-50(82)70-39/h1-4,8-11,18-19,25-26,29-30,39-47,68-69,79H,5-7,12-17,20-24,27-28,60H2,(H2,61,80)(H2,62,81)(H,63,66)(H,64,67)(H,65,90)(H,70,82)(H,71,84)(H,72,83)(H,73,85)(H,74,88)(H,75,89)(H,76,86)(H,77,87)/t39-,40-,41-,42-,43-,44-,45-,46-,47-/m0/s1</moldb-inchi>
  <moldb-inchikey>QMAOBPTXTXJMIM-CSYZDTNESA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">1258.369</moldb-average-mass>
  <moldb-mono-mass type="decimal">1257.579174</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>CHEM127981</chemdb-id>
  <dsstox-id>DTXSID30163819</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00134305</susdat-id>
  <iupac>5-Oxo-L-prolyl-L-histidyl-3-(1H-indol-2-yl)-L-alanyl-L-seryl-L-histidyl-L-asparaginyl-3-(1H-indol-2-yl)-L-alanyl-L-lysyl-L-prolylglycinamide</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>Organic Polymers</superklass>
  <klass>Polypeptides</klass>
  <subklass nil="true"/>
  <paper-count type="integer">11</paper-count>
  <sync-id>CED0035067</sync-id>
  <structure-inchikey>RTASYRSYWSLWJV-CSYZDTNESA-N</structure-inchikey>
  <structure-fingerprint>40000000000000000001c000000805000808010000000000440000020000200400000000000400200080000020280020040000000000000200400000208000000000100000000005000000000000c00000a0000000004000004008009000000000000000030000000400000000000000000000031100000000000400000000100800000000000020800002200000044080001000000100000000000001000000112000000004000004040000080040000000004080080000008000000004000000000000050000000100800040002000000004800000000000600212000001000000000000008000004041000020010400004000000020000000004088000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ����������������[���b���€���`�������`�������`�������`�������`������ 4��������h��������(�������(������ 4��������`������@(������@h�������@8�������@(������@h�������@h�������@h�������@h�������@(�������h��������(�������(������ 4��������`�������(�������h��������(�������h��������(�������(������ 4��������`������@(������@h�������@8�������@h�������@(�������h��������(�������(������ 4��������`�������`�������h��������(�������(������ 4��������`������@(������@h�������@8�������@(������@h�������@h�������@h�������@h�������@(�������h��������(�������(������ 4��������`������@(������@h�������@8�������@h�������@(�������h��������(�������(������ 4��������`�������`�������(�������(�������h��������(�������(�������(�������`�������`�������`������ 4��������(�������(�������h��������`�������(�������h��������(�������������������������� ��(��	�	
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����h��h��h���h���h���h���h���h�	���� ��(������������ ��(������ ��(����� � !�!"h�"#h�#$h�$%h��&amp;�&amp;' '((�')�)*�*+�),�,- -.(�-/�/0�01�12h�23h�34h�45h�56h�67h�78h�89h�/:�:; ;&lt;(�;=�=&gt;�&gt;?�?@h�@Ah�ABh�BCh�=D�DE EF(�EG�GH�HI�IJ�JK(�JL �M�MN(�MO OP�PQ�QR�RS�ST�TU(�TV VW�WX�XY XZ(���h�%!h�91h�C?h�LG�SO���h�94h�B�����������������"!%$#�21943�567894�@?CBA�HGLJI�POSRQ����������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T04:49:00Z</structure-indexed-at>
</compound>
