EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:97589 - LSM-8968

ChEBI IDCHEBI:97589
ChEBI NameLSM-8968
Stars
DownloadsMolfile
FormulaC28H34F3N3O5S
Net Charge0
Average Mass581.657
Monoisotopic Mass581.21713
SMILESC[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)CC(F)(F)F)OCc2ccccc2-c2c(n(C)c3ccccc23)C1=O
InChIInChI=1S/C28H34F3N3O5S/c1-18-13-34(19(2)15-35)27(36)26-25(22-11-7-8-12-23(22)33(26)4)21-10-6-5-9-20(21)16-39-24(18)14-32(3)40(37,38)17-28(29,30)31/h5-12,18-19,24,35H,13-17H2,1-4H3/t18-,19+,24-/m0/s1
InChIKeyBZAPUCLBFKATKI-GLDPYIMESA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
LSM-8968 (CHEBI:97589) is a indolyl carboxylic acid (CHEBI:46867)
Manual XrefsDatabases
LSM-8968LINCS