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Amyloid P-IN-1

CAT: 0931-T14283-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-T14283-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1819986-22-5
Target
Beta Amyloid
Related Pathways
Neuroscience
Purity
0.9976
Bioactivity
Amyloid P-IN-1 can be used in studies about diseases with depletion of serum amyloid P components such as Alzheimer's disease, amyloidosis, osteoarthritis, and type 2 diabetes mellitus.
Smiles
O=C(OCOC(=O)[C@H]1CCCN1C(=O)CCCCC(=O)N1CCC[C@@H]1C(=O)OCOC(=O)OC1CCOCC1)OC1CCOCC1
Molecular Formula
C30H44N2O14
Molecular Weight
656.68
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

amyloid P-IN-1
CAS Number1819986-22-5
PubChem CID92136018
IUPAC Nameoxan-4-yloxycarbonyloxymethyl (2R)-1-[6-[(2R)-2-(oxan-4-yloxycarbonyloxymethoxycarbonyl)pyrrolidin-1-yl]-6-oxohexanoyl]pyrrolidine-2-carboxylate
Molecular FormulaC30H44N2O14
Molecular Weight656.7
XLogP2.3
Topological Polar Surface Area183
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count14
Rotatable Bond Count19
Heavy Atom Count46
Formal Charge0
Complexity976
SMILES
C1C[C@@H](N(C1)C(=O)CCCCC(=O)N2CCC[C@@H]2C(=O)OCOC(=O)OC3CCOCC3)C(=O)OCOC(=O)OC4CCOCC4
InChI
InChI=1S/C30H44N2O14/c33-25(31-13-3-5-23(31)27(35)41-19-43-29(37)45-21-9-15-39-16-10-21)7-1-2-8-26(34)32-14-4-6-24(32)28(36)42-20-44-30(38)46-22-11-17-40-18-12-22/h21-24H,1-20H2/t23-,24-/m1/s1
InChIKey
KSKLDMGKWDUQCT-DNQXCXABSA-N
Chemical Structure
2D Structure
2D structure of amyloid P-IN-1
CAS: 1819986-22-5
CID: 92136018
Formula: C30H44N2O14
MW: 656.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight656.7
XLogP32.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count14
Rotatable Bond Count19
Exact Mass656.27925408
Monoisotopic Mass656.27925408
Topological Polar Surface Area183 Ų
Heavy Atom Count46
Formal Charge0
Complexity976
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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