EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:39613 - 2-PHENYLAMINO-ETHANESULFONIC ACID

Default Structure
ChEBI IDCHEBI:39613
ChEBI Name2-PHENYLAMINO-ETHANESULFONIC ACID
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC8H11NO3S
Net Charge0
Average Mass201.247
Monoisotopic Mass201.04596
SMILES[H]OS(=O)(=O)C([H])([H])C([H])([H])N([H])c1c([H])c([H])c([H])c([H])c1[H]
InChIInChI=1S/C8H11NO3S/c10-13(11,12)7-6-9-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,10,11,12)
InChIKeyIAVHKMVGTPXJIC-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-PHENYLAMINO-ETHANESULFONIC ACID (CHEBI:39613) is a unclassifieds (CHEBI:27189)
Synonyms  Source
2-PHENYLAMINO-ETHANESULFONIC ACIDPDBeChem
2-(phenylamino)ethanesulfonic acidPDBeChem
Manual XrefsDatabases
171PDBeChem