EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:98613 - LSM-9992

ChEBI IDCHEBI:98613
ChEBI NameLSM-9992
Stars
DownloadsMolfile
FormulaC27H34N4O3S
Net Charge0
Average Mass494.661
Monoisotopic Mass494.23516
SMILESO=C([C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(C4=CCCCC4)c3=O)[C@H]1N2Cc1nccs1)N1CCCCC1
InChIInChI=1S/C27H34N4O3S/c32-17-20-22-15-31-21(10-9-19(26(31)33)18-7-3-1-4-8-18)25(30(22)16-23-28-11-14-35-23)24(20)27(34)29-12-5-2-6-13-29/h7,9-11,14,20,22,24-25,32H,1-6,8,12-13,15-17H2/t20-,22-,24+,25+/m0/s1
InChIKeyFBECFQSMPRXHSL-MMTHZHQFSA-N
ChEBI Ontology
Outgoing Relation(s)
LSM-9992 (CHEBI:98613) is a N-acylpiperidine (CHEBI:48591)
Manual XrefsDatabases
LSM-9992LINCS