Ilomastat (GM6001)

CAT: 0957-S7157-5mgSize: 5 mgDry Ice: YesHazardous: No

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CAT#:0957-S7157-5mgSize:5 mg

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CAS Number

142880-36-2

Synonyms

Galardin

Target

MMP

Applications

Proteases

Smiles

CC (C) CC (CC (=O) NO) C (=O) NC (CC1=CNC2=CC=CC=C21) C (=O) NC

Molecular Formula

C20H28N4O4

Additionnal Information

Ilomastat (GM6001) is a broad spectrum matrix metalloprotease (MMP) inhibitor for MMP-1, MMP-2, MMP-3, MMP-7, MMP-8, MMP-9, MMP-12, MMP-14, and MMP-26 with Ki of 0.4 nM, 0.5 nM, 27 nM, 3.7 nM, 0.1 nM, 0.2 nM, 3.6 nM, 13.4 nM, 0.36 nM, respectively.

Storage Conditions

2 years -80 in solvent

Chemical Information

Ilomastat

Ilomastat is an N-acyl-amino acid obtained by formal condensation of the carboxy group of (2R)-2-[2-(hydroxyamino)-2-oxoethyl]-4-methylpentanoic acid with the amino group of N-methyl-L-tryptophanamide. A cell permeable broad-spectrum matrix metalloproteinase (MMP) inhibitor. It has a role as an antibacterial agent, an antineoplastic agent, a neuroprotective agent, an anti-inflammatory agent and an EC 3.4.24.24 (gelatinase A) inhibitor. It is a hydroxamic acid, a L-tryptophan derivative and a N-acyl-amino acid.

CAS Number	142880-36-2
PubChem CID	132519
IUPAC Name	(2R)-N'-hydroxy-N-[(2S)-3-(1H-indol-3-yl)-1-(methylamino)-1-oxopropan-2-yl]-2-(2-methylpropyl)butanediamide
Molecular Formula	C20H28N4O4
Molecular Weight	388.5
XLogP	0.9
Topological Polar Surface Area	123
Hydrogen Bond Donor Count	5
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	9
Heavy Atom Count	28
Formal Charge	0
Complexity	554

SMILES

CC(C)C[C@H](CC(=O)NO)C(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)NC

InChI

InChI=1S/C20H28N4O4/c1-12(2)8-13(10-18(25)24-28)19(26)23-17(20(27)21-3)9-14-11-22-16-7-5-4-6-15(14)16/h4-7,11-13,17,22,28H,8-10H2,1-3H3,(H,21,27)(H,23,26)(H,24,25)/t13-,17+/m1/s1

InChIKey

NITYDPDXAAFEIT-DYVFJYSZSA-N

Chemical Structure

2D Structure

CAS: 142880-36-2

CID: 132519

Formula: C20H28N4O4

MW: 388.5

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	388.5
XLogP3	0.9
Hydrogen Bond Donor Count	5
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	9
Exact Mass	388.21105539
Monoisotopic Mass	388.21105539
Topological Polar Surface Area	123 Å²
Heavy Atom Count	28
Formal Charge	0
Complexity	554
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Alternative Products

Catalog	Name
C12487-5mg	Ilomastat (GM6001)
MBS130458-01	GM6001 (galardin, ilomastat)
MBS576658	Ilomastat (GM6001, Galardin)
MBS655392-01	GM6001, Powder (Ilomastat, MMP Inhibitor, Galardin)
I5500-01	Ilomastat, Liquid (GM6001, MMP Inhibitor, Galardin)
M11809-01	Ilomastat
B2357-1	EZSolution™ GM6001
HY-15768R-01	Ilomastat (Standard)
GTR19174659-01	Ilomastat (GM-6001)
SF4180-10mM	Ilomastat (MMP inhibitor)

Ilomastat (GM6001)

Chemical Information

Alternative Products

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