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CKK-E15

CAT: 0013-GTR19232667-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19232667-01Size:10 mg
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Description
CKK-E15 is a peptide-lipid conjugate essential for formulating the LNP3 lipid nanoparticle system, which also includes C14PEG2000, cholesterol, and DOPE. This formulation is widely used in research for the in vitro and in vivo delivery of nucleic acids, including mRNA and siRNA, for therapeutic development.
CAS Number
1432494-71-7
Field of Research
Metabolism Research
Smiles
C (CCCN (CC (CCCCCCCCCCCCC) O) CC (CCCCCCCCCCCCC) O) C1C (=O) NC (CCCCN (CC (CCCCCCCCCCCCC) O) CC (CCCCCCCCCCCCC) O) C (=O) N1
Molecular Formula
C72H144N4O6
Molecular Weight
1161.94
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

3,6-Bis[4-[bis(2-hydroxypentadecyl)amino]butyl]piperazine-2,5-dione
CAS Number1432494-71-7
PubChem CID89534839
IUPAC Name3,6-bis[4-[bis(2-hydroxypentadecyl)amino]butyl]piperazine-2,5-dione
Molecular FormulaC72H144N4O6
Molecular Weight1161.9
XLogP25.2
Topological Polar Surface Area146
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count8
Rotatable Bond Count66
Heavy Atom Count82
Formal Charge0
Complexity1180
SMILES
CCCCCCCCCCCCCC(CN(CCCCC1C(=O)NC(C(=O)N1)CCCCN(CC(CCCCCCCCCCCCC)O)CC(CCCCCCCCCCCCC)O)CC(CCCCCCCCCCCCC)O)O
InChI
InChI=1S/C72H144N4O6/c1-5-9-13-17-21-25-29-33-37-41-45-53-65(77)61-75(62-66(78)54-46-42-38-34-30-26-22-18-14-10-6-2)59-51-49-57-69-71(81)74-70(72(82)73-69)58-50-52-60-76(63-67(79)55-47-43-39-35-31-27-23-19-15-11-7-3)64-68(80)56-48-44-40-36-32-28-24-20-16-12-8-4/h65-70,77-80H,5-64H2,1-4H3,(H,73,82)(H,74,81)
InChIKey
FGDZRFPFIDLJAJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3,6-Bis[4-[bis(2-hydroxypentadecyl)amino]butyl]piperazine-2,5-dione
CAS: 1432494-71-7
CID: 89534839
Formula: C72H144N4O6
MW: 1161.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight1161.9
XLogP325.2
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count8
Rotatable Bond Count66
Exact Mass1161.10858833
Monoisotopic Mass1161.10858833
Topological Polar Surface Area146 Ų
Heavy Atom Count82
Formal Charge0
Complexity1180
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count6
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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