<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">357440</id>
  <title nil="true"/>
  <common-name>[(9e,19e,21e)-2,15,17,27,29-pentahydroxy-26-[(e)-[[2-[2-(hydroxymethyl)phenyl]acetyl]hydrazinylidene]methyl]-11-methoxy-3,7,12,14,16,18,22-heptamethyl-6,23-dioxo-8,30-dioxa-24-azatetracyclo[23.3.1.14,7.05,28]triaconta-1(29),2,4,9,19,21,25,27-octaen-13-yl] acetate</common-name>
  <description>[(9e,19e,21e)-2,15,17,27,29-pentahydroxy-26-[(e)-[[2-[2-(hydroxymethyl)phenyl]acetyl]hydrazinylidene]methyl]-11-methoxy-3,7,12,14,16,18,22-heptamethyl-6,23-dioxo-8,30-dioxa-24-azatetracyclo[23.3.1.14,7.05,28]triaconta-1(29),2,4,9,19,21,25,27-octaen-13-yl] acetate is a chemical compound with the formula C47H57N3O14. With an average molecular weight of 888.00 g/mol, [(9e,19e,21e)-2,15,17,27,29-pentahydroxy-26-[(e)-[[2-[2-(hydroxymethyl)phenyl]acetyl]hydrazinylidene]methyl]-11-methoxy-3,7,12,14,16,18,22-heptamethyl-6,23-dioxo-8,30-dioxa-24-azatetracyclo[23.3.1.14,7.05,28]triaconta-1(29),2,4,9,19,21,25,27-octaen-13-yl] acetate is a heavy molecule.</description>
  <cas>57165-95-4</cas>
  <pubchem-id>135611785</pubchem-id>
  <chemical-formula>C47H57N3O14</chemical-formula>
  <weight>888</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">2026-09-01T04:32:05Z</created-at>
  <updated-at type="dateTime">2026-09-01T04:32:05Z</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>CC1C=CC=C(C(=O)NC2=C(C(=C3C(=C2O)C(=C(C4=C3C(=O)C(O4)(OC=CC(C(C(C(C(C(C1O)C)O)C)OC(=O)C)C)OC)C)C)O)O)C=NNC(=O)CC5=CC=CC=C5CO)C</moldb-smiles>
  <moldb-formula>C47H57N3O14</moldb-formula>
  <moldb-inchi>InChI=1S/C47H57N3O14/c1-22-13-12-14-23(2)46(60)49-37-31(20-48-50-33(53)19-29-15-10-11-16-30(29)21-51)41(57)34-35(42(37)58)40(56)27(6)44-36(34)45(59)47(8,64-44)62-18-17-32(61-9)24(3)43(63-28(7)52)26(5)39(55)25(4)38(22)54/h10-18,20,22,24-26,32,38-39,43,51,54-58H,19,21H2,1-9H3,(H,49,60)(H,50,53)/b13-12+,18-17+,23-14+,48-20+</moldb-inchi>
  <moldb-inchikey>HOBFYMBTRIETNW-MCOQJCDMSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">887.3840535</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>4.9</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>CHEM353333</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>[(9e,19e,21e)-2,15,17,27,29-pentahydroxy-26-[(e)-[[2-[2-(hydroxymethyl)phenyl]acetyl]hydrazinylidene]methyl]-11-methoxy-3,7,12,14,16,18,22-heptamethyl-6,23-dioxo-8,30-dioxa-24-azatetracyclo[23.3.1.14,7.05,28]triaconta-1(29),2,4,9,19,21,25,27-octaen-13-yl] acetate</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" nil="true"/>
  <sync-id>CED0307688</sync-id>
  <structure-inchikey>HOBFYMBTRIETNW-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40000000009000000000000000000000000000002001020000000908000008004000220400000200000000000000200000400010020000100000000041000000000a0200002000000000000020800000000300000004000000000000000000010000000440000280000800000040480140000002000000000000500090000048000010800400200200000080000000000100000000000040400020200280040000000004000000080000000000200000000000000100000040000000004000050000042000000020000044000008000000022000001200008008000804000040000000001148040000000400010002040040008000000010000004</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ����������������@���D���€���`�������`�������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;�&amp;' '((�')��*��+�+,��-��.��/ �0 
1 12(�23 34 45(�46�67�78h�89h�9:h�:;h�;&lt;h�&lt;=�=&gt;��?�!���	h���h��� &lt;7h�B��������������	
�������89:;&lt;7��! �������������
	��������	�������! ����������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:55:13Z</structure-indexed-at>
</compound>
