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CHEBI:107160 - 2-[[(3,4-dimethoxyphenyl)-oxomethyl]amino]acetic acid [2-[5-(4-chlorophenyl)-3-(2-furanyl)-3,4-dihydropyrazol-2-yl]-2-oxoethyl] ester

ChEBI IDCHEBI:107160
ChEBI Name2-[[(3,4-dimethoxyphenyl)-oxomethyl]amino]acetic acid [2-[5-(4-chlorophenyl)-3-(2-furanyl)-3,4-dihydropyrazol-2-yl]-2-oxoethyl] ester
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DownloadsMolfile
FormulaC26H24ClN3O7
Net Charge0
Average Mass525.945
Monoisotopic Mass525.13028
SMILESCOc1ccc(C(=O)NCC(=O)OCC(=O)N2N=C(c3ccc(Cl)cc3)CC2c2ccco2)cc1OC
InChIInChI=1S/C26H24ClN3O7/c1-34-22-10-7-17(12-23(22)35-2)26(33)28-14-25(32)37-15-24(31)30-20(21-4-3-11-36-21)13-19(29-30)16-5-8-18(27)9-6-16/h3-12,20H,13-15H2,1-2H3,(H,28,33)
InChIKeyKEFFGNCGFQKDAH-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
2-[[(3,4-dimethoxyphenyl)-oxomethyl]amino]acetic acid [2-[5-(4-chlorophenyl)-3-(2-furanyl)-3,4-dihydropyrazol-2-yl]-2-oxoethyl] ester (CHEBI:107160) is a depsipeptide (CHEBI:23643)
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