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CPP9

CAT: 0804-HY-P10644Size: 1 EachDry Ice: NoHazardous: No
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Description
CPP9 is a small, amphipathic, cyclic cell penetrating peptide (CPP) . CPPs bind directly to the plasma membrane phospholipids and enter mammalian cells via endocytosis, followed by efficient release from the endosome. CPP9 can be used for intracellular delivery of therapeutic agents and chemical probes[1].
CAS Number
1831064-63-1
UNSPSC
12352209
Target
Fluorescent Dye
Type
Peptides
Related Pathways
Others
Applications
Cancer-programmed cell death
Field of Research
Cancer
Assay Protocol
https://www.medchemexpress.com/cpp9.html
Smiles
O=C(N[C@@H](CCCNC(N)=N)C(N[C@H](CCCNC(N)=N)C(N[C@@H](CCCNC(N)=N)C(N[C@H](CCCNC(N)=N)C(N[C@H]1CCC(N)=O)=O)=O)=O)=O)[C@@H](NC([C@@H](CC2=CC=CC=C2)NC1=O)=O)CC3=CC=C4C=CC=CC4=C3
Molecular Formula
C51H76N20O8
Molecular Weight
1097.28
References & Citations
[1]Qian Z, et al. Discovery and Mechanism of Highly Efficient Cyclic Cell-Penetrating Peptides. Biochemistry. 2016 May 10;55 (18) :2601-12.
Shipping Conditions
Room temperature
Scientific Category
Peptides
Clinical Information
No Development Reported

Chemical Information

Cpp9 (tfa)
CAS Number1831064-63-1
PubChem CID162654193
IUPAC Name3-[(2S,5R,8S,11S,14R,17S,20R)-5-benzyl-11,14,17,20-tetrakis[3-(diaminomethylideneamino)propyl]-8-(naphthalen-2-ylmethyl)-3,6,9,12,15,18,21-heptaoxo-1,4,7,10,13,16,19-heptazacyclohenicos-2-yl]propanamide
Molecular FormulaC51H76N20O8
Molecular Weight1097.3
XLogP-3.3
Topological Polar Surface Area504
Hydrogen Bond Donor Count16
Hydrogen Bond Acceptor Count12
Rotatable Bond Count23
Heavy Atom Count79
Formal Charge0
Complexity2150
SMILES
C1=CC=C(C=C1)C[C@@H]2C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N2)CCC(=O)N)CCCN=C(N)N)CCCN=C(N)N)CCCN=C(N)N)CCCN=C(N)N)CC3=CC4=CC=CC=C4C=C3
InChI
InChI=1S/C51H76N20O8/c52-40(72)21-20-37-45(77)70-38(27-29-10-2-1-3-11-29)47(79)71-39(28-30-18-19-31-12-4-5-13-32(31)26-30)46(78)68-36(17-9-25-64-51(59)60)43(75)66-34(15-7-23-62-49(55)56)41(73)65-33(14-6-22-61-48(53)54)42(74)67-35(44(76)69-37)16-8-24-63-50(57)58/h1-5,10-13,18-19,26,33-39H,6-9,14-17,20-25,27-28H2,(H2,52,72)(H,65,73)(H,66,75)(H,67,74)(H,68,78)(H,69,76)(H,70,77)(H,71,79)(H4,53,54,61)(H4,55,56,62)(H4,57,58,63)(H4,59,60,64)/t33-,34+,35+,36-,37-,38+,39-/m0/s1
InChIKey
WVBOCYPQZGZLLP-KNEAGCMXSA-N
Chemical Structure
2D Structure
2D structure of Cpp9 (tfa)
CAS: 1831064-63-1
CID: 162654193
Formula: C51H76N20O8
MW: 1097.3
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight1097.3
XLogP3-3.3
Hydrogen Bond Donor Count16
Hydrogen Bond Acceptor Count12
Rotatable Bond Count23
Exact Mass1096.61549946
Monoisotopic Mass1096.61549946
Topological Polar Surface Area504 Ų
Heavy Atom Count79
Formal Charge0
Complexity2150
Isotope Atom Count0
Defined Atom Stereocenter Count7
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes