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Amyloid β-Protein (33-42)

CAT: 1410-M40699Size: 1 EachDry Ice: NoHazardous: No
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Description
Amyloid β-Protein (33-42)
CAS Number
178949-81-0
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
915.17
Molecular Formula
C41H74N10O11S
Notes
Research use only, not for human use.
Receptor
Other Targets

Chemical Information

Amyloid beta-protein (33-42)
CAS Number178949-81-0
PubChem CID9988345
IUPAC Name(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[2-[[2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[(2-aminoacetyl)amino]-4-methylpentanoyl]amino]-4-methylsulfanylbutanoyl]amino]-3-methylbutanoyl]amino]acetyl]amino]acetyl]amino]-3-methylbutanoyl]amino]-3-methylbutanoyl]amino]-3-methylpentanoyl]amino]propanoic acid
Molecular FormulaC41H74N10O11S
Molecular Weight915.2
XLogP-0.3
Topological Polar Surface Area351
Hydrogen Bond Donor Count11
Hydrogen Bond Acceptor Count13
Rotatable Bond Count29
Heavy Atom Count63
Formal Charge0
Complexity1580
SMILES
CC[C@H](C)[C@@H](C(=O)N[C@@H](C)C(=O)O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)NC(=O)CNC(=O)CNC(=O)[C@H](C(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)CN
InChI
InChI=1S/C41H74N10O11S/c1-13-24(10)34(40(60)45-25(11)41(61)62)51-39(59)33(23(8)9)50-38(58)32(22(6)7)48-30(54)19-43-29(53)18-44-37(57)31(21(4)5)49-35(55)26(14-15-63-12)47-36(56)27(16-20(2)3)46-28(52)17-42/h20-27,31-34H,13-19,42H2,1-12H3,(H,43,53)(H,44,57)(H,45,60)(H,46,52)(H,47,56)(H,48,54)(H,49,55)(H,50,58)(H,51,59)(H,61,62)/t24-,25-,26-,27-,31-,32-,33-,34-/m0/s1
InChIKey
BTMBQGFLPKEANW-IYEOHQHLSA-N
Chemical Structure
2D Structure
2D structure of Amyloid beta-protein (33-42)
CAS: 178949-81-0
CID: 9988345
Formula: C41H74N10O11S
MW: 915.2
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight915.2
XLogP3-0.3
Hydrogen Bond Donor Count11
Hydrogen Bond Acceptor Count13
Rotatable Bond Count29
Exact Mass914.52592439
Monoisotopic Mass914.52592439
Topological Polar Surface Area351 Ų
Heavy Atom Count63
Formal Charge0
Complexity1580
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