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CHEBI:231364 - riviciclib

ChEBI IDCHEBI:231364
ChEBI Nameriviciclib
Stars
DefinitionA synthetic dihydroxyflavone that is 5,7-dihydroxyflavone which is substituted by a (2R,3S)-2-(hydroxymethyl)-1-methylpyrrolidin-3-yl group at position 8 and by a chlorine at the 2' position. A cyclin-dependent kinase inhibitor that exhibits anti-cancer properties.
Last Modified9 May 2024
Submitterdelphine
DownloadsMolfile
FormulaC21H20ClNO5
Net Charge0
Average Mass401.846
Monoisotopic Mass401.10300
SMILES[H][C@@]1(c2c(O)cc(O)c3c(=O)cc(-c4ccccc4Cl)oc23)CCN(C)[C@H]1CO
InChIInChI=1S/C21H20ClNO5/c1-23-7-6-12(14(23)10-24)19-15(25)8-16(26)20-17(27)9-18(28-21(19)20)11-4-2-3-5-13(11)22/h2-5,8-9,12,14,24-26H,6-7,10H2,1H3/t12-,14+/m1/s1
InChIKeyQLUYMIVVAYRECT-OCCSQVGLSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
EC 2.7.11.22 (cyclin-dependent kinase) inhibitor  An EC 2.7.11.* (protein-serine/threonine kinase) inhibitor that interferes with the action of cyclin-dependent kinase (EC 2.7.11.22).
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
riviciclib (CHEBI:231364) has role antineoplastic agent (CHEBI:35610)
riviciclib (CHEBI:231364) has role EC 2.7.11.22 (cyclin-dependent kinase) inhibitor (CHEBI:82665)
riviciclib (CHEBI:231364) is a N-alkylpyrrolidine (CHEBI:46775)
riviciclib (CHEBI:231364) is a dihydroxyflavone (CHEBI:38686)
riviciclib (CHEBI:231364) is a monochlorobenzenes (CHEBI:83403)
riviciclib (CHEBI:231364) is a primary alcohol (CHEBI:15734)
IUPAC Name 
2-(2-chlorophenyl)-5,7-dihydroxy-8-[(2R,3S)-2-(hydroxymethyl)-1-methylpyrrolidin-3-yl]-4H-chromen-4-one
INNs  Source
riviciclibWHO MedNet
riviciclibumWHO MedNet
riviciclibWHO MedNet
riviciclibWHO MedNet
Synonyms  Source
P276-00 free baseSUBMITTER
P-27600 free baseChEBI
2-(2-chlorophenyl)-5,7-dihydroxy-8-[(2R,3S)-2-(hydroxymethyl)-1-methylpyrrolidin-3-yl]-4H-1-benzopyran-4-oneIUPAC
P276-00 (free base)ChEBI
Manual XrefsDatabases
US2010152129Patent
Registry NumbersSources
CAS:920113-02-6ChEBI
Citations