CHEBI:230905 - Ribociclib

ChEBI IDCHEBI:230905
ChEBI NameRibociclib
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H30N8O
Net Charge0
Average Mass434.548
Monoisotopic Mass434.25426
SMILESCN(C)C(=O)c1cc2cnc(Nc3ccc(N4CCNCC4)cn3)nc2n1C1CCCC1
InChIInChI=1S/C23H30N8O/c1-29(2)22(32)19-13-16-14-26-23(28-21(16)31(19)17-5-3-4-6-17)27-20-8-7-18(15-25-20)30-11-9-24-10-12-30/h7-8,13-15,17,24H,3-6,9-12H2,1-2H3,(H,25,26,27,28)
InChIKeyRHXHGRAEPCAFML-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS9100)
ChEBI Ontology
Outgoing Relation(s)
Ribociclib (CHEBI:230905) is a piperazines (CHEBI:26144)
Ribociclib (CHEBI:230905) is a pyridines (CHEBI:26421)
IUPAC Name 
7-cyclopentyl-N,N-dimethyl-2-[(5-piperazin-1-ylpyridin-2-yl)amino]pyrrolo[2,3-d]pyrimidine-6-carboxamide
Manual XrefsDatabases
5218DrugCentral
LSM-45221LINCS
DB11730DrugBank
6ZZPDBeChem
HMDB0257211HMDB
30798107ChemSpider
D10883KEGG DRUG