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CHEBI:49384 - (2S)-2-(3-{[1-(4-METHOXYBENZOYL)-2-METHYL-5-(TRIFLUOROMETHOXY)-1H-INDOL-3-YL]METHYL}PHENOXY)PROPANOIC ACID

Default Structure
ChEBI IDCHEBI:49384
ChEBI Name(2S)-2-(3-{[1-(4-METHOXYBENZOYL)-2-METHYL-5-(TRIFLUOROMETHOXY)-1H-INDOL-3-YL]METHYL}PHENOXY)PROPANOIC ACID
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Last Modified17 October 2009
DownloadsMolfile
FormulaC28H24F3NO6
Net Charge0
Average Mass527.495
Monoisotopic Mass527.15557
SMILES[H]OC(=O)[C@@]([H])(Oc1c([H])c([H])c([H])c(C([H])([H])c2c(C([H])([H])[H])n(C(=O)c3c([H])c([H])c(OC([H])([H])[H])c([H])c3[H])c3c([H])c([H])c(OC(F)(F)F)c([H])c23)c1[H])C([H])([H])[H]
InChIInChI=1S/C28H24F3NO6/c1-16-23(14-18-5-4-6-21(13-18)37-17(2)27(34)35)24-15-22(38-28(29,30)31)11-12-25(24)32(16)26(33)19-7-9-20(36-3)10-8-19/h4-13,15,17H,14H2,1-3H3,(H,34,35)/t17-/m0/s1
InChIKeyOFCWBJAYEIROGZ-KRWDZBQOSA-N
ChEBI Ontology
Outgoing Relation(s)
(2S)-2-(3-{[1-(4-METHOXYBENZOYL)-2-METHYL-5-(TRIFLUOROMETHOXY)-1H-INDOL-3-YL]METHYL}PHENOXY)PROPANOIC ACID (CHEBI:49384) is a unclassifieds (CHEBI:27189)
Synonyms  Source
(2S)-2-(3-{[1-(4-METHOXYBENZOYL)-2-METHYL-5-(TRIFLUOROMETHOXY)-1H-INDOL-3-YL]METHYL}PHENOXY)PROPANOIC ACIDPDBeChem
(2S)-2-[3-({1-[(4-methoxyphenyl)carbonyl]-2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl}methyl)phenoxy]propanoic acidPDBeChem
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