CHEBI:101257 - GGTI-2133 free base

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ChEBI Name GGTI-2133 free base
ChEBI ID CHEBI:101257
Definition An N-acyl-L-amino acid obtained by condensation of the carboxy group of 4-{[(imidazol-4-yl)methyl]amino}-2-(naphthalen-1-yl)benzoic acid with the amino group of L-leucine. An inhibitor of geranylgeranyltransferase type I.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C27H28N4O3
Net Charge 0
Average Mass 456.537
Monoisotopic Mass 456.21614
InChI InChI=1S/C27H28N4O3/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/h3-11,13-14,16-17,25,29H,12,15H2,1-2H3,(H,28,30)(H,31,32)(H,33,34)/t25-/m0/s1
InChIKey ODTFPKNIFYMEHP-VWLOTQADSA-N
SMILES C([C@H](CC(C)C)NC(=O)C1=C(C=C(C=C1)NCC=2NC=NC2)C=3C4=C(C=CC=C4)C=CC3)(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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 free base (CHEBI:101257) has role EC 2.5.1.59 (protein geranylgeranyltransferase type I) inhibitor (CHEBI:67267)
GGTI-2133 free base (CHEBI:101257) is a N-acyl-L-amino acid (CHEBI:21644)
GGTI-2133 free base (CHEBI:101257) is a L-leucine derivative (CHEBI:25018)
GGTI-2133 free base (CHEBI:101257) is a benzamides (CHEBI:22702)
GGTI-2133 free base (CHEBI:101257) is a biaryl (CHEBI:64459)
GGTI-2133 free base (CHEBI:101257) is a imidazoles (CHEBI:24780)
GGTI-2133 free base (CHEBI:101257) is a naphthalenes (CHEBI:25477)
GGTI-2133 free base (CHEBI:101257) is a secondary amino compound (CHEBI:50995)
GGTI-2133 free base (CHEBI:101257) is a substituted aniline (CHEBI:48975)
GGTI-2133 free base (CHEBI:101257) is conjugate base of GGTI-2133 free base(1+) (CHEBI:101333)
Incoming GGTI-2133 free base(1+) (CHEBI:101333) is conjugate acid of GGTI-2133 free base (CHEBI:101257)
IUPAC Name
N-[4-{[(1H-imidazol-4-yl)methyl]amino}-2-(naphthalen-1-yl)benzoyl]-L-leucine
Synonym Source
GGTI 2133 free base ChEBI
Registry Number Type Source
25113814 Reaxys Registry Number Reaxys
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