315320 <common-name>2-amino-n-[4-amino-3-[3-amino-6-(ethylaminomethyl)oxan-2-yl]oxy-2-hydroxy-6-methoxycyclohexyl]-n-methylacetamide</common-name> <description nil="true"/> <cas nil="true"/> <pubchem-id>3068826</pubchem-id> <chemical-formula>C18H37N5O5</chemical-formula> <weight>403.5</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">2026-08-29T12:41:16Z</created-at> <updated-at type="dateTime">2026-08-29T12:41:16Z</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>CCNCC1CCC(C(O1)OC2C(CC(C(C2O)N(C)C(=O)CN)OC)N)N</moldb-smiles> <moldb-formula>C18H37N5O5</moldb-formula> <moldb-inchi>InChI=1S/C18H37N5O5/c1-4-22-9-10-5-6-11(20)18(27-10)28-17-12(21)7-13(26-3)15(16(17)25)23(2)14(24)8-19/h10-13,15-18,22,25H,4-9,19-21H2,1-3H3</moldb-inchi> <moldb-inchikey>XKGUGTMUSMUVIP-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">403.2794693</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>-3</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>CHEM311213</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>2-amino-n-[4-amino-3-[3-amino-6-(ethylaminomethyl)oxan-2-yl]oxy-2-hydroxy-6-methoxycyclohexyl]-n-methylacetamide</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 oxygen compounds</superklass> <klass>Organooxygen compounds</klass> <subklass>Carbohydrates and carbohydrate conjugates</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0266188</sync-id> <structure-inchikey>XKGUGTMUSMUVIP-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>90000000000000800000400000000400400400200000000400000000000000000002002000000000000000000000000000000000000000000000000000000000000000000000000000000000000020800000000100000000000000000000000002010000000140000000004000000080020040000000000400000800100000000040000400000008000000000080101000000000000000020020400000000800002014000800000000040180000000000000000000000100000800000000000000000000000800000000000000000000000000000200100000000000000000000000800000100000000040000440000002080000000000000000002000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`�������`�������`�������`�������`�������`�������`�������`�������`������� ������ ������`�������`�������`�������`�������`�������`�������`�������(�������`�������(�������(�������`�������`������� ������`�������`�������`������������������������������� �� � ������ � ������������������� ��(������������������� �����B������ ������ ��������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:21:35Z</structure-indexed-at> </compound>