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Implitapide

CAT: 0804-HY-106130-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-106130-01Size:5 mg
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Description
Implitapide (AEGR 427) is a microsomal triglyceride transfer protein (MTP) inhibitor.
CAS Number
177469-96-4
Product Name Alternative
AEGR 427
UNSPSC
12352005
Target
Microsomal Triglyceride Transfer Protein (MTP)
Type
Reference compound
Related Pathways
Metabolic Enzyme/Protease
Applications
Metabolism-sugar/lipid metabolism
Field of Research
Metabolic Disease; Cardiovascular Disease
Assay Protocol
https://www.medchemexpress.com/Implitapide.html
Purity
99.87
Solubility
DMSO : 100 mg/mL (ultrasonic)
Smiles
CC1=C(C2=C3C=CC=C2)C(N3CC4=CC=C([C@H](C5CCCC5)C(N[C@H](C6=CC=CC=C6)CO)=O)C=C4)=NC(C)=C1
Molecular Formula
C35H37N3O2
Molecular Weight
531.69
References & Citations
[1]Ueshima K, et al. Implitapide, a microsomal triglyceride transfer protein inhibitor, reduces progression of atherosclerosis in apolipoprotein E knockout mice fed a Western-type diet: involvement of the inhibition of postprandial triglyceride elevation. Biol Pharm Bull. 2005 Feb;28 (2) :247-52.
Shipping Conditions
Blue Ice
Storage Conditions
-20°C (Powder, stored under nitrogen)
Scientific Category
Reference compound1
Clinical Information
Phase 2

Chemical Information

Implitapide

Implitapide is a microsomal triglyceride transfer protein (MTP)-inhibitor.

CAS Number177469-96-4
PubChem CID5745206
IUPAC Name(2S)-2-cyclopentyl-2-[3-[(2,4-dimethylpyrido[2,3-b]indol-9-yl)methyl]phenyl]-N-[(1R)-2-hydroxy-1-phenylethyl]acetamide
Molecular FormulaC35H37N3O2
Molecular Weight531.7
XLogP7.3
Topological Polar Surface Area67.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count8
Heavy Atom Count40
Formal Charge0
Complexity823
SMILES
CC1=CC(=NC2=C1C3=CC=CC=C3N2CC4=CC(=CC=C4)[C@H](C5CCCC5)C(=O)N[C@@H](CO)C6=CC=CC=C6)C
InChI
InChI=1S/C35H37N3O2/c1-23-19-24(2)36-34-32(23)29-17-8-9-18-31(29)38(34)21-25-11-10-16-28(20-25)33(27-14-6-7-15-27)35(40)37-30(22-39)26-12-4-3-5-13-26/h3-5,8-13,16-20,27,30,33,39H,6-7,14-15,21-22H2,1-2H3,(H,37,40)/t30-,33-/m0/s1
InChIKey
AMNXBQPRODZJQR-DITALETJSA-N
Chemical Structure
2D Structure
2D structure of Implitapide
CAS: 177469-96-4
CID: 5745206
Formula: C35H37N3O2
MW: 531.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight531.7
XLogP37.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count8
Exact Mass531.28857743
Monoisotopic Mass531.28857743
Topological Polar Surface Area67.2 Ų
Heavy Atom Count40
Formal Charge0
Complexity823
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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