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CHEBI:109594 - 2-[4-[[3-[2-(1H-indol-3-yl)ethyl]-2-(4-methoxyphenyl)imino-4-oxo-5-thiazolidinylidene]methyl]phenoxy]acetic acid

ChEBI IDCHEBI:109594
ChEBI Name2-[4-[[3-[2-(1H-indol-3-yl)ethyl]-2-(4-methoxyphenyl)imino-4-oxo-5-thiazolidinylidene]methyl]phenoxy]acetic acid
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FormulaC29H25N3O5S
Net Charge0
Average Mass527.602
Monoisotopic Mass527.15149
SMILESCOc1ccc(N=C2SC(=Cc3ccc(OCC(=O)O)cc3)C(=O)N2CCc2cnc3ccccc23)cc1
InChIInChI=1S/C29H25N3O5S/c1-36-22-12-8-21(9-13-22)31-29-32(15-14-20-17-30-25-5-3-2-4-24(20)25)28(35)26(38-29)16-19-6-10-23(11-7-19)37-18-27(33)34/h2-13,16-17,30H,14-15,18H2,1H3,(H,33,34)
InChIKeyWZPMXNLVZLIWBV-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
2-[4-[[3-[2-(1H-indol-3-yl)ethyl]-2-(4-methoxyphenyl)imino-4-oxo-5-thiazolidinylidene]methyl]phenoxy]acetic acid (CHEBI:109594) is a monocarboxylic acid (CHEBI:25384)
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