CHEBI:70723 - reversine

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ChEBI Name reversine
ChEBI ID CHEBI:70723
Definition A member of the class of purines that is 9H-purine in which the hydrogens at positions 2 and 6 are replaced by a [4-(morpholin-4-yl)phenyl]nitrilo group and a cyclohexylamino group, respectively.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C21H27N7O
Net Charge 0
Average Mass 393.48540
Monoisotopic Mass 393.228
InChI InChI=1S/C21H27N7O/c1-2-4-15(5-3-1)24-20-18-19(23-14-22-18)26-21(27-20)25-16-6-8-17(9-7-16)28-10-12-29-13-11-28/h6-9,14-15H,1-5,10-13H2,(H3,22,23,24,25,26,27)
InChIKey ZFLJHSQHILSNCM-UHFFFAOYSA-N
SMILES C1CCC(CC1)Nc1nc(Nc2ccc(cc2)N2CCOCC2)nc2[nH]cnc12
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Biological Role(s): Aurora kinase inhibitor
Any protein kinase inhibitor that inhibits the action of an Aurora kinase (a group of serine/threonine kinases that are essential for cell proliferation).
cell dedifferentiation agent
Any compound which induces a partially or terminally differentiated cell to revert to an earlier developmental stage.
adenosine A3 receptor antagonist
An antagonist at the A3 receptor.
Application(s): antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing reversine (CHEBI:70723) has functional parent 9H-purine-2,6-diamine (CHEBI:40235)
reversine (CHEBI:70723) has role adenosine A3 receptor antagonist (CHEBI:70725)
reversine (CHEBI:70723) has role antineoplastic agent (CHEBI:35610)
reversine (CHEBI:70723) has role Aurora kinase inhibitor (CHEBI:70770)
reversine (CHEBI:70723) has role cell dedifferentiation agent (CHEBI:70724)
reversine (CHEBI:70723) is a morpholines (CHEBI:38785)
reversine (CHEBI:70723) is a purines (CHEBI:26401)
reversine (CHEBI:70723) is a secondary amino compound (CHEBI:50995)
reversine (CHEBI:70723) is a tertiary amino compound (CHEBI:50996)
IUPAC Name
N6-cyclohexyl-N2-[4-(morpholin-4-yl)phenyl]-9H-purine-2,6-diamine
Synonym Source
2-(4-morpholinoanilino)-6-cyclohexylaminopurine ChEBI
Manual Xrefs Databases
LSM-5842 LINCS
Reversine Wikipedia
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Registry Numbers Types Sources
656820-32-5 CAS Registry Number ChemIDplus
9591952 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
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Last Modified
25 February 2016