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β-Amyloid (1-9)

CAT: 0804-HY-P1854Size: 1 EachDry Ice: NoHazardous: No
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Description
β-Amyloid (1-9), an N-terminal fragment of beta amyloid, consists of amino acid residues 1 to 9. β-Amyloid (1-9) contains a B cell epitope, but it does not include T cell epitopes. Omission of residues 1 to 9 from the full-length Alzheimer'sβ-Amyloid peptide 1 to 40 does not prevent the peptide from forming amyloid fibrils or eliminate fibril polymorphism [1][2].
CAS Number
147529-30-4
UNSPSC
12352209
Target
Amyloid-β
Type
Peptides
Related Pathways
Neuronal Signaling
Applications
Neuroscience-Neurodegeneration
Field of Research
Neurological Disease
Assay Protocol
https://www.medchemexpress.com/beta-amyloid-1-9.html
Solubility
10 mM in DMSO
Smiles
O=C(O)CNC([C@H](CO)NC([C@H](CC(O)=O)NC([C@H](CC1=CNC=N1)NC([C@H](CCCNC(N)=N)NC([C@H](CC2=CC=CC=C2)NC([C@H](CCC(O)=O)NC([C@H](C)NC([C@H](CC(O)=O)N)=O)=O)=O)=O)=O)=O)=O)=O
Molecular Formula
C42H60N14O17
Molecular Weight
1033.01
References & Citations
[1]Zamora E, et al. Papillomavirus-like particles are an effective platform for amyloid-beta immunization in rabbitsand transgenic mice. J Immunol. 2006 Aug 15;177 (4) :2662-2670.|[2]Paravastu AK, et al. Polymorphic fibril formation by residues 10-40 of the Alzheimer's beta-amyloid peptide. Biophys J. 2006 Jun 15;90 (12) :4618-29.
Shipping Conditions
Room temperature
Scientific Category
Peptides
Clinical Information
No Development Reported

Chemical Information

beta-Amyloid 1-9
CAS Number147529-30-4
PubChem CID10079740
IUPAC Name(4S)-4-[[(2S)-2-[[(2S)-2-amino-3-carboxypropanoyl]amino]propanoyl]amino]-5-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-3-carboxy-1-[[(2S)-1-(carboxymethylamino)-3-hydroxy-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-5-oxopentanoic acid
Molecular FormulaC42H60N14O17
Molecular Weight1033.0
XLogP-8.6
Topological Polar Surface Area521
Hydrogen Bond Donor Count17
Hydrogen Bond Acceptor Count20
Rotatable Bond Count33
Heavy Atom Count73
Formal Charge0
Complexity2000
SMILES
C[C@@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC2=CN=CN2)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)NC(=O)[C@H](CC(=O)O)N
InChI
InChI=1S/C42H60N14O17/c1-20(50-35(67)23(43)14-31(60)61)34(66)51-25(9-10-30(58)59)38(70)53-26(12-21-6-3-2-4-7-21)39(71)52-24(8-5-11-47-42(44)45)37(69)54-27(13-22-16-46-19-49-22)40(72)55-28(15-32(62)63)41(73)56-29(18-57)36(68)48-17-33(64)65/h2-4,6-7,16,19-20,23-29,57H,5,8-15,17-18,43H2,1H3,(H,46,49)(H,48,68)(H,50,67)(H,51,66)(H,52,71)(H,53,70)(H,54,69)(H,55,72)(H,56,73)(H,58,59)(H,60,61)(H,62,63)(H,64,65)(H4,44,45,47)/t20-,23-,24-,25-,26-,27-,28-,29-/m0/s1
InChIKey
BRRKPUCEVBBGNV-WVQSQKPFSA-N
Chemical Structure
2D Structure
2D structure of beta-Amyloid 1-9
CAS: 147529-30-4
CID: 10079740
Formula: C42H60N14O17
MW: 1033.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight1033.0
XLogP3-8.6
Hydrogen Bond Donor Count17
Hydrogen Bond Acceptor Count20
Rotatable Bond Count33
Exact Mass1032.42608650
Monoisotopic Mass1032.42608650
Topological Polar Surface Area521 Ų
Heavy Atom Count73
Formal Charge0
Complexity2000
Isotope Atom Count0
Defined Atom Stereocenter Count8
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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