328519 <common-name>[(2s,3r,5r,6r)-5-hydroxy-2-methyl-6-[(2r)-5-oxohexan-2-yl]oxyoxan-3-yl] 1h-indole-3-carboxylate</common-name> <description>[(2s,3r,5r,6r)-5-hydroxy-2-methyl-6-[(2r)-5-oxohexan-2-yl]oxyoxan-3-yl] 1h-indole-3-carboxylate is a compound with the formula C21H27NO6. It has an average molecular weight of 389.40 g/mol.</description> <cas nil="true"/> <pubchem-id>132934130</pubchem-id> <chemical-formula>C21H27NO6</chemical-formula> <weight>389.4</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">2026-08-30T08:25:47Z</created-at> <updated-at type="dateTime">2026-08-30T08:25:47Z</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(O1)OC(C)CCC(=O)C)O)OC(=O)C2=CNC3=CC=CC=C32</moldb-smiles> <moldb-formula>C21H27NO6</moldb-formula> <moldb-inchi>InChI=1S/C21H27NO6/c1-12(23)8-9-13(2)26-21-18(24)10-19(14(3)27-21)28-20(25)16-11-22-17-7-5-4-6-15(16)17/h4-7,11,13-14,18-19,21-22,24H,8-10H2,1-3H3/t13-,14+,18-,19-,21-/m1/s1</moldb-inchi> <moldb-inchikey>VNOOSCCMEMBAAB-BEMBYLKPSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">389.1838376</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>2.2</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>CHEM324412</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>[(2s,3r,5r,6r)-5-hydroxy-2-methyl-6-[(2r)-5-oxohexan-2-yl]oxyoxan-3-yl] 1h-indole-3-carboxylate</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>Organoheterocyclic compounds</superklass> <klass>Indoles and derivatives</klass> <subklass>Indolecarboxylic acids and derivatives</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0279108</sync-id> <structure-inchikey>VNOOSCCMEMBAAB-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>400800000000000400008000000001000000401000000000000000000000000000000010000200000080000000000000000000000000000000000040000040000000000200000000000000000000000000208000000001000000200010000000800000020300000000004000010000080000000200000000000000000000005000000000c8000000804000200200000000000000000100000000000000400400000800040010000000040000080000000000000000000000000000004000000000020008040000100000000000000000000000000000000000000200000001000000000000000000000041000000000440004080000000000100002000000000</structure-fingerprint> <structure-pattern-fingerprint>501400100d128e4481001b508128a000000014008105200400352040822008cc44220010138000000100410800c00000046002a4c09c32010026647100a04000c7110c001290040000901070027203000804059851211b3240040462500249020c2805270048020061000601c5b40040208680700125e0041109286802590012504400084ef0820808060250cb2c0008193c081244c01e83100e082000c08084004310900890c00002000960017d2d120ac000038941084818804a1008c0c212a00002a40490023301800400551102800c010000020050200d4002040800030090104810088102200000041151522084005000308042840e4008130050000002</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`�������`�������`�������`�������`�������`������� ������ ������`�������`�������`�������`�������(�������(�������`�������`�������(�������(�������(������@(������@h�������@8�������@(������@h�������@h�������@h�������@h�������@(������������������������������� �� � ������ ������������� ��(��� ��h���h���h���h���h���h���h���h������h���h�B����������������������������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:31:35Z</structure-indexed-at> </compound>