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AMP-PCP

CAT: 1410-M21917-01Size: 1 EachDry Ice: NoHazardous: No
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Description
AMP-PCP is an ATP analogue and can bind to Hsp90 N-terminal domain with a Kd value of 3.8 μM. AMP-PCP binding favors the formation of the active homodimer of Hsp90.
CAS Number
3469-78-1
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
505.21
Molecular Formula
C₁₁H₁₈N₅O₁₂P₃
Notes
Research use only, not for human use.
Receptor
HSP90

Chemical Information

beta,gamma-Methylene ATP

Adenosine 5'-[beta,gamma-methylene]triphosphate is a nucleoside triphosphate analogue.

CAS Number3469-78-1
PubChem CID91532
IUPAC Name[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]methylphosphonic acid
Molecular FormulaC11H18N5O12P3
Molecular Weight505.21
XLogP-5.9
Topological Polar Surface Area270
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count16
Rotatable Bond Count8
Heavy Atom Count31
Formal Charge0
Complexity800
SMILES
C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(CP(=O)(O)O)O)O)O)N
InChI
InChI=1S/C11H18N5O12P3/c12-9-6-10(14-2-13-9)16(3-15-6)11-8(18)7(17)5(27-11)1-26-31(24,25)28-30(22,23)4-29(19,20)21/h2-3,5,7-8,11,17-18H,1,4H2,(H,22,23)(H,24,25)(H2,12,13,14)(H2,19,20,21)/t5-,7-,8-,11-/m1/s1
InChIKey
UFZTZBNSLXELAL-IOSLPCCCSA-N
Chemical Structure
2D Structure
2D structure of beta,gamma-Methylene ATP
CAS: 3469-78-1
CID: 91532
Formula: C11H18N5O12P3
MW: 505.21
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight505.21
XLogP3-5.9
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count16
Rotatable Bond Count8
Exact Mass505.01648202
Monoisotopic Mass505.01648202
Topological Polar Surface Area270 Ų
Heavy Atom Count31
Formal Charge0
Complexity800
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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