CHEBI:117101 - 2-[bis(2-methylpropoxy)phosphoryl]-3,3,3-trifluoro-2-[(4-methylphenyl)sulfonylamino]propanoic acid ethyl ester

ChEBI IDCHEBI:117101
ChEBI Name2-[bis(2-methylpropoxy)phosphoryl]-3,3,3-trifluoro-2-[(4-methylphenyl)sulfonylamino]propanoic acid ethyl ester
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FormulaC20H31F3NO7PS
Net Charge0
Average Mass517.503
Monoisotopic Mass517.15109
SMILESCCOC(=O)C(NS(=O)(=O)c1ccc(C)cc1)(C(F)(F)F)P(=O)(OCC(C)C)OCC(C)C
InChIInChI=1S/C20H31F3NO7PS/c1-7-29-18(25)19(20(21,22)23,24-33(27,28)17-10-8-16(6)9-11-17)32(26,30-12-14(2)3)31-13-15(4)5/h8-11,14-15,24H,7,12-13H2,1-6H3
InChIKeyKREHTTSFYWSORW-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[bis(2-methylpropoxy)phosphoryl]-3,3,3-trifluoro-2-[(4-methylphenyl)sulfonylamino]propanoic acid ethyl ester (CHEBI:117101) is a sulfonamide (CHEBI:35358)
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LSM-28548LINCS