CHEBI:93873 - 2-[(4-methylphenyl)sulfonylamino]pentanoic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-[(4-methylphenyl)sulfonylamino]pentanoic acid
ChEBI ID CHEBI:93873
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C12H17NO4S
Net Charge 0
Average Mass 271.334
Monoisotopic Mass 271.08783
InChI InChI=1S/C12H17NO4S/c1-3-4-11(12(14)15)13-18(16,17)10-7-5-9(2)6-8-10/h5-8,11,13H,3-4H2,1-2H3,(H,14,15)
InChIKey QJJISNOGSSHKFX-UHFFFAOYSA-N
SMILES CCCC(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)C
ChEBI Ontology
Outgoing 2-[(4-methylphenyl)sulfonylamino]pentanoic acid (CHEBI:93873) is a sulfonamide (CHEBI:35358)
Manual Xref Database
LSM-4447 LINCS
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