95705 <common-name>6'-N-acetylsisomicin</common-name> <description>6'-N-acetylsisomicin belongs to the carbohydrates and carbohydrate conjugates, a subclass of organooxygen compounds within the organic compounds. This compound has the formula C21H39N5O8 and an average molecular weight of 489.57 g/mol.</description> <cas>53759-83-4</cas> <pubchem-id>103824</pubchem-id> <chemical-formula>C21H39N5O8</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">2026-04-05T03:35:41Z</created-at> <updated-at type="dateTime">2026-04-05T03:35:41Z</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>CNC1C(O)C(OC2C(N)CC(N)C(O)C2O)OCC1(C)OC1OC(CN=C(C)O)=CCC1N</moldb-smiles> <moldb-formula>C21H39N5O8</moldb-formula> <moldb-inchi>InChI=1/C21H39N5O8/c1-9(27)26-7-10-4-5-11(22)19(32-10)34-21(2)8-31-20(16(30)18(21)25-3)33-17-13(24)6-12(23)14(28)15(17)29/h4,11-20,25,28-30H,5-8,22-24H2,1-3H3,(H,26,27)</moldb-inchi> <moldb-inchikey>MPHWRXDRITYEGT-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">489.57</moldb-average-mass> <moldb-mono-mass type="decimal">489.2798632</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>CHEM091598</chemdb-id> <dsstox-id>DTXSID20968532</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00057711</susdat-id> <iupac nil="true"/> <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 oxygen compounds</superklass> <klass>Organooxygen compounds</klass> <subklass>Carbohydrates and carbohydrate conjugates</subklass> <paper-count type="integer">2</paper-count> <sync-id>CED0055496</sync-id> <structure-inchikey>MPHWRXDRITYEGT-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>2000100000000000008200010000000000000000000000000000000000000000108000000000000000002000000800040000000000000000000000000000000000000000000000000082000000000000008000000001000000040000020000000000002100000000000000000080000000000200000000000000000000005000000000480004000000080000000000800014000000400100880000204000200008002020100000000000000c100000000002800000000000012004000000000000000000000000c000000000000000000000000040001000008080000004000000000000800000020040000200000000000102000000000000008000000000</structure-fingerprint> <structure-pattern-fingerprint>7014c8008512826081001b708138a2001800140c85052010803d20c08224484c6c2200d1138000000100410800c0000004600224409d3221002e657982a04010c7110c981280142041901050127602080804c58851211e3340040462402641040c38212f004c022041081480ddf400cc308680528901e1061138244002590002d040100c4ef0820808060250c92c00883b1d8c5244401f0a502808a060c0018401d3103100b2d22002040d68016f35140ac000038941084010984a100cc0a212a00002a40498023319c08680555102910c050010038870000d6002002801030090384d141881012c11400401511228a6005004b092c2942e1100110052060202</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ����������������"���$���€���`�������`�������`�������`�������`�������`������� ������`�������`�������`�������`�������`�������`�������`�������`�������`�������`������� ������`������� ������`������� ������`�������(�������(�������`�������(�������(�������`�������h��������h��������`�������`�������`������������������������������� �� � ������ � �� ���������������������������� ��������(������ ��(����� � !���� �����B������������� � ������� �����������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:36:33Z</structure-indexed-at> </compound>