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2'-Deoxy-N6-Phenoxyacetyladenosine

CAT: 0931-TNU0703-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-TNU0703-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
110522-74-2
Target
Nucleoside Antimetabolite/Analog, Others
Related Pathways
Cell Cycle/Checkpoint, DNA Damage/DNA Repair, Others
Bioactivity
2'-Deoxynucleoside,2/6/8-Modified nucleoside
Smiles
N(C(COC1=CC=CC=C1)=O)C2=C3C(N(C=N3)[C@@H]4O[C@H](CO)[C@@H](O)C4)=NC=N2
Molecular Formula
C18H19N5O5
Molecular Weight
385.37
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

2'-Deoxy-N6-phenoxyacetyladenosine
CAS Number110522-74-2
PubChem CID10524130
IUPAC NameN-[9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]-2-phenoxyacetamide
Molecular FormulaC18H19N5O5
Molecular Weight385.4
XLogP0.3
Topological Polar Surface Area132
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count8
Rotatable Bond Count6
Heavy Atom Count28
Formal Charge0
Complexity534
SMILES
C1[C@@H]([C@H](O[C@H]1N2C=NC3=C(N=CN=C32)NC(=O)COC4=CC=CC=C4)CO)O
InChI
InChI=1S/C18H19N5O5/c24-7-13-12(25)6-15(28-13)23-10-21-16-17(19-9-20-18(16)23)22-14(26)8-27-11-4-2-1-3-5-11/h1-5,9-10,12-13,15,24-25H,6-8H2,(H,19,20,22,26)/t12-,13+,15+/m0/s1
InChIKey
HWSKJANFAKYDDL-GZBFAFLISA-N
Chemical Structure
2D Structure
2D structure of 2'-Deoxy-N6-phenoxyacetyladenosine
CAS: 110522-74-2
CID: 10524130
Formula: C18H19N5O5
MW: 385.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight385.4
XLogP30.3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count8
Rotatable Bond Count6
Exact Mass385.13861872
Monoisotopic Mass385.13861872
Topological Polar Surface Area132 Ų
Heavy Atom Count28
Formal Charge0
Complexity534
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
295901-012'-Deoxy-N6-phenoxyacetyladenosine
ND08050-012'-Deoxy-5'-O-DMT-N6-phenoxyacetyladenosine
GTR19214778-01N6-Phenoxyacetyladenosine
NM084272'-O-Methyl-N6-phenoxyacetyladenosine
PD09150-012'-Deoxy-5'-O-DMT-N6-phenoxyacetyladenosine 3'-CE phosphoramidite
297999-012'-Deoxy-5'-O-DMT-N6-phenoxyacetyladenosine 3'-Me phosphonamidite
PD09151-012'-Deoxy-5'-O-DMT-N6-phenoxyacetyladenosine 3'-Me phosphoramidite
PD157583-012'-Deoxy-5'-O-DMT-2'-fluoro-N6-phenoxyacetyladenosine 3'-CE phosphoramidite
GTR19214170-012'-Deoxy-N6, N6-dimethyladenosine
MBS58269612'-Deoxy-N6,N6-dimethyladenosine

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