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2-Cl-cAMP

CAT: 0931-T88630-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T88630-02Size:50 mg
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CAS Number
39023-65-9
Target
Others, PKA
Related Pathways
Tyrosine Kinase/Adaptors, Others
Bioactivity
2-Cl-cAMP is a potent agonist of cAMP-dependent protein kinases (such as types PKAI and II) and serves as a starting material for the synthesis of cyclic nucleotides.
Smiles
NC1=C2C(N(C=N2)[C@H]3[C@H](O)[C@]4([C@](O3)(COP(=O)(O)O4)[H])[H])=NC(Cl)=N1
Molecular Formula
C10H11ClN5O6P
Molecular Weight
363.65
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

2-Chloroadenosine-3',5'-cyclic monophosphate sodium salt
CAS Number39023-65-9
PubChem CID74084866
IUPAC Namesodium 6-(6-amino-2-chloropurin-9-yl)-2-oxido-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol
Molecular FormulaC10H10ClN5NaO6P
Molecular Weight385.63
Topological Polar Surface Area158
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count10
Rotatable Bond Count1
Heavy Atom Count24
Formal Charge0
Complexity538
SMILES
C1C2C(C(C(O2)N3C=NC4=C(N=C(N=C43)Cl)N)O)OP(=O)(O1)[O-].[Na+]
InChI
InChI=1S/C10H11ClN5O6P.Na/c11-10-14-7(12)4-8(15-10)16(2-13-4)9-5(17)6-3(21-9)1-20-23(18,19)22-6;/h2-3,5-6,9,17H,1H2,(H,18,19)(H2,12,14,15);/q;+1/p-1
InChIKey
MWJRNVCKDZDUNH-UHFFFAOYSA-M
Chemical Structure
2D Structure
2D structure of 2-Chloroadenosine-3',5'-cyclic monophosphate sodium salt
CAS: 39023-65-9
CID: 74084866
Formula: C10H10ClN5NaO6P
MW: 385.63
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight385.63
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count10
Rotatable Bond Count1
Exact Mass384.9954920
Monoisotopic Mass384.9954920
Topological Polar Surface Area158 Ų
Heavy Atom Count24
Formal Charge0
Complexity538
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count4
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes