CHEBI:101279 - GGTI-2133

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ChEBI Name GGTI-2133
ChEBI ID CHEBI:101279
Definition An organoammonium salt resulting from the mixing of equimolar amounts of GGTI-2133 free base and trifluoroacetic acid. An inhibitor of geranylgeranyltransferase type I.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C29H29F3N4O5
Net Charge 0
Average Mass 570.561
Monoisotopic Mass 570.20900
InChI InChI=1S/C27H28N4O3.C2HF3O2/c1-17(2)12-25(27(33)34)31-26(32)23-11-10-19(29-15-20-14-28-16-30-20)13-24(23)22-9-5-7-18-6-3-4-8-21(18)22;3-2(4,5)1(6)7/h3-11,13-14,16-17,25,29H,12,15H2,1-2H3,(H,28,30)(H,31,32)(H,33,34);(H,6,7)/t25-;/m0./s1
InChIKey FXXUNOYBYJFSRB-UQIIZPHYSA-N
SMILES C(C([O-])=O)(F)(F)F.C([C@H](CC(C)C)NC(=O)C1=C(C=C(C=C1)[NH2+]CC=2NC=NC2)C=3C4=C(C=CC=C4)C=CC3)(O)=O
Roles Classification
Biological Role(s): EC 2.5.1.59 (protein geranylgeranyltransferase type I) inhibitor
An EC 2.5.1.* (non-methyl-alkyl or aryl transferase) inhibitor that interferes with the action of protein geranylgeranyltransferase type I (EC 2.5.1.59).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing GGTI-2133 (CHEBI:101279) has part GGTI-2133 free base(1+) (CHEBI:101333)
GGTI-2133 (CHEBI:101279) has part trifluoroacetate (CHEBI:27110)
GGTI-2133 (CHEBI:101279) has role EC 2.5.1.59 (protein geranylgeranyltransferase type I) inhibitor (CHEBI:67267)
GGTI-2133 (CHEBI:101279) is a organoammonium salt (CHEBI:46850)
IUPAC Names
4-{[(1S)-1-carboxy-3-methylbutyl]carbamoyl}-N-[(1H-imidazol-4-yl)methyl]-3-(naphthalen-1-yl)anilinium trifluoroacetate
N-[4-{[(1H-imidazol-4-yl)methyl]amino}-2-(naphthalen-1-yl)benzoyl]-L-leucine trifluoroacetate
Synonym Source
GGTI 2133 ChEBI
Citations Waiting for Citations Types Sources
23335799 PubMed citation Europe PMC
23415632 PubMed citation Europe PMC
23649168 PubMed citation Europe PMC
23744643 PubMed citation Europe PMC
24486886 PubMed citation Europe PMC
25882623 PubMed citation Europe PMC
Last Modified
01 April 2016