CHEBI:90682 - torin 2

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ChEBI Name torin 2
ChEBI ID CHEBI:90682
Definition A member of the class of pyridoquinolines that is benzo[h][1,6]naphthyridin-2-one carrying additional 3-(trifluoromethyl)phenyl and 6-aminopyridin-3-yl substituents at positions 1 and 9 respectively. It is a potent inhibitor of mTOR and exhibits anti-cancer properties.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Matthias Ziehm
Supplier Information
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Formula C24H15F3N4O
Net Charge 0
Average Mass 432.398
Monoisotopic Mass 432.120
InChI InChI=1S/C24H15F3N4O/c25-24(26,27)17-2-1-3-18(11-17)31-22(32)9-6-16-13-29-20-7-4-14(10-19(20)23(16)31)15-5-8-21(28)30-12-15/h1-13H,(H2,28,30)
InChIKey GUXXEUUYCAYESJ-UHFFFAOYSA-N
SMILES C1=C(C2=CC=C3C(=C2)C4=C(C=CC(N4C5=CC(=CC=C5)C(F)(F)F)=O)C=N3)C=NC(=C1)N
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): mTOR inhibitor
A protein kinase inhibitor of the mammalian target of rapamycin (mTOR), a protein that regulates cell growth, cell proliferation, cell motility, cell survival, protein synthesis and transcription. mTOR inhibitors are used to prevent transplant rejection and in treatment of cancer.
Application(s): antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing torin 2 (CHEBI:90682) has role antineoplastic agent (CHEBI:35610)
torin 2 (CHEBI:90682) has role mTOR inhibitor (CHEBI:68481)
torin 2 (CHEBI:90682) is a aminopyridine (CHEBI:38207)
torin 2 (CHEBI:90682) is a organofluorine compound (CHEBI:37143)
torin 2 (CHEBI:90682) is a primary amino compound (CHEBI:50994)
torin 2 (CHEBI:90682) is a pyridoquinoline (CHEBI:38921)
IUPAC Name
9-(6-aminopyridin-3-yl)-1-[3-(trifluoromethyl)phenyl]benzo[h][1,6]naphthyridin-2(1H)-one
Synonym Source
torin2 ChEBI
Manual Xrefs Databases
17G PDBeChem
LSM-1080 LINCS
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Registry Number Type Source
20268159 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
23436801 PubMed citation Europe PMC
23636326 PubMed citation Europe PMC
24459013 PubMed citation Europe PMC
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24801387 PubMed citation Europe PMC
25296981 PubMed citation Europe PMC
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26023849 PubMed citation Europe PMC
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Last Modified
08 July 2016