EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:44233 - 2-(TOLUENE-4-SULFONYL)-2H-BENZO[D][1,2,3]DIAZABORININ-1-OL

Default Structure
ChEBI IDCHEBI:44233
ChEBI Name2-(TOLUENE-4-SULFONYL)-2H-BENZO[D][1,2,3]DIAZABORININ-1-OL
Stars
Last Modified17 October 2009
DownloadsMolfile
FormulaC14H13BN2O3S
Net Charge0
Average Mass300.148
Monoisotopic Mass300.07399
SMILES[H]OB1c2c([H])c([H])c([H])c([H])c2C([H])=NN1S(=O)(=O)c1c([H])c([H])c(C([H])([H])[H])c([H])c1[H]
InChIInChI=1S/C14H13BN2O3S/c1-11-6-8-13(9-7-11)21(19,20)17-15(18)14-5-3-2-4-12(14)10-16-17/h2-10,18H,1H3
InChIKeyUQIDNSKBUXCODH-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-(TOLUENE-4-SULFONYL)-2H-BENZO[D][1,2,3]DIAZABORININ-1-OL (CHEBI:44233) is a unclassifieds (CHEBI:27189)
Synonyms  Source
2-[(4-methylphenyl)sulfonyl]-2,3,1-benzodiazaborinin-1(2H)-olPDBeChem
2-(TOLUENE-4-SULFONYL)-2H-BENZO[D][1,2,3]DIAZABORININ-1-OLPDBeChem
Manual XrefsDatabases
NDTPDBeChem