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DC4 Crosslinker

CAT: 0013-GTR19232878-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19232878-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
DC4 crosslinker is an 18Å mass spectrometry-cleavable reagent with two intrinsic positive charges, enabling efficient identification of protein-protein interactions. It facilitates structural proteomics studies in vitro by generating characteristic peptide ion pairs and subsequent sequence ions for precise mapping.
CAS Number
1374647-94-5
Field of Research
Signal Transduction
Smiles
[Br-].[Br-].O=C (CCC[N+]12CC[N+] (CCCC (=O) ON3C (=O) CCC3=O) (CC1) CC2) ON1C (=O) CCC1=O
Molecular Formula
C22H32Br2N4O8
Molecular Weight
640.326
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

DC4 Crosslinker
CAS Number1374647-94-5
PubChem CID129887550
IUPAC Name(2,5-dioxopyrrolidin-1-yl) 4-[4-[4-(2,5-dioxopyrrolidin-1-yl)oxy-4-oxobutyl]-1,4-diazoniabicyclo[2.2.2]octan-1-yl]butanoate dibromide
Molecular FormulaC22H32Br2N4O8
Molecular Weight640.3
Topological Polar Surface Area127
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count10
Rotatable Bond Count12
Heavy Atom Count36
Formal Charge0
Complexity775
SMILES
C1CC(=O)N(C1=O)OC(=O)CCC[N+]23CC[N+](CC2)(CC3)CCCC(=O)ON4C(=O)CCC4=O.[Br-].[Br-]
InChI
InChI=1S/C22H32N4O8.2BrH/c27-17-5-6-18(28)23(17)33-21(31)3-1-9-25-11-14-26(15-12-25,16-13-25)10-2-4-22(32)34-24-19(29)7-8-20(24)30;;/h1-16H2;2*1H/q+2;;/p-2
InChIKey
AJWAJFDEYIAPKX-UHFFFAOYSA-L
Chemical Structure
2D Structure
2D structure of DC4 Crosslinker
CAS: 1374647-94-5
CID: 129887550
Formula: C22H32Br2N4O8
MW: 640.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight640.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count10
Rotatable Bond Count12
Exact Mass640.05664
Monoisotopic Mass638.05869
Topological Polar Surface Area127 Ų
Heavy Atom Count36
Formal Charge0
Complexity775
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes

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