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CHEBI:47151 - 1-(5-CARBOXYPENTYL)-5-(2,6-DICHLOROBENZYLOXY)-1H-INDOLE-2-CARBOXYLIC ACID

Default Structure
ChEBI IDCHEBI:47151
ChEBI Name1-(5-CARBOXYPENTYL)-5-(2,6-DICHLOROBENZYLOXY)-1H-INDOLE-2-CARBOXYLIC ACID
Stars
Last Modified17 October 2009
DownloadsMolfile
FormulaC22H21Cl2NO5
Net Charge0
Average Mass450.318
Monoisotopic Mass449.07968
SMILES[H]OC(=O)c1c([H])c2c([H])c(OC([H])([H])c3c(Cl)c([H])c([H])c([H])c3Cl)c([H])c([H])c2n1C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C(=O)O[H]
InChIInChI=1S/C22H21Cl2NO5/c23-17-5-4-6-18(24)16(17)13-30-15-8-9-19-14(11-15)12-20(22(28)29)25(19)10-3-1-2-7-21(26)27/h4-6,8-9,11-12H,1-3,7,10,13H2,(H,26,27)(H,28,29)
InChIKeyJTGPYFFQVOIJKR-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-(5-CARBOXYPENTYL)-5-(2,6-DICHLOROBENZYLOXY)-1H-INDOLE-2-CARBOXYLIC ACID (CHEBI:47151) is a unclassifieds (CHEBI:27189)
Synonyms  Source
1-(5-carboxypentyl)-5-[(2,6-dichlorobenzyl)oxy]-1H-indole-2-carboxylic acidPDBeChem
1-(5-CARBOXYPENTYL)-5-(2,6-DICHLOROBENZYLOXY)-1H-INDOLE-2-CARBOXYLIC ACIDPDBeChem
Manual XrefsDatabases
669PDBeChem