CHEBI:121343 - 4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoic acid (4-oxo-2,3-dihydro-1H-cyclopenta[c][1]benzopyran-7-yl) ester

ChEBI IDCHEBI:121343
ChEBI Name4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoic acid (4-oxo-2,3-dihydro-1H-cyclopenta[c][1]benzopyran-7-yl) ester
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FormulaC25H27NO6S
Net Charge0
Average Mass469.559
Monoisotopic Mass469.15591
SMILESCc1ccc(S(=O)(=O)NC(CC(C)C)C(=O)Oc2ccc3c4c(c(=O)oc3c2)CCC4)cc1
InChIInChI=1S/C25H27NO6S/c1-15(2)13-22(26-33(29,30)18-10-7-16(3)8-11-18)25(28)31-17-9-12-20-19-5-4-6-21(19)24(27)32-23(20)14-17/h7-12,14-15,22,26H,4-6,13H2,1-3H3
InChIKeyDFDYEYULIXRTID-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoic acid (4-oxo-2,3-dihydro-1H-cyclopenta[c][1]benzopyran-7-yl) ester (CHEBI:121343) is a leucine derivative (CHEBI:47003)
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