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CHEBI:143306 - 2-[(3E)-6-fluoro-2-(hydroxymethyl)-3-[(4-methylsulfinylphenyl)methylidene]inden-1-yl]acetic acid

ChEBI IDCHEBI:143306
ChEBI Name2-[(3E)-6-fluoro-2-(hydroxymethyl)-3-[(4-methylsulfinylphenyl)methylidene]inden-1-yl]acetic acid
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FormulaC20H17FO4S
Net Charge0
Average Mass372.417
Monoisotopic Mass372.08316
SMILESC[S@](=O)c1ccc(/C=C2/C(CO)=C(CC(=O)O)c3cc(F)ccc32)cc1
InChIInChI=1S/C20H17FO4S/c1-26(25)14-5-2-12(3-6-14)8-16-15-7-4-13(21)9-17(15)18(10-20(23)24)19(16)11-22/h2-9,22H,10-11H2,1H3,(H,23,24)/b16-8+/t26-/m0/s1
InChIKeyYNFJNUKAJTWEPC-JKWYCWKNSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[(3E)-6-fluoro-2-(hydroxymethyl)-3-[(4-methylsulfinylphenyl)methylidene]inden-1-yl]acetic acid (CHEBI:143306) is a indene (CHEBI:37910)