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3'-O-Levulinyl-2'-deoxyadenosine

CAT: 0013-GTR19214436-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19214436-01Size:5 mg
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Description
These nucleoside derivatives feature a 3'-modification and selectively protected amino or hydroxyl groups, enabling site-specific conjugation. They serve as essential building blocks for synthesizing oligonucleotide probes and therapeutic conjugates, widely used in biochemical research, drug discovery, and both in vitro and in vivo studies.
CAS Number
440327-45-7
Field of Research
Cell Biology, Molecular Biology
Smiles
NC1=C2C (N (C=N2) [C@H]3C[C@H] (OC (CCC (C) =O) =O) [C@@H] (CO) O3) =NC=N1
Molecular Formula
C15H19N5O5
Molecular Weight
349.34
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

3'-o-Levulinyl-2'-deoxyadenosine
CAS Number440327-45-7
PubChem CID11110869
IUPAC Name[(2R,3S,5R)-5-(6-aminopurin-9-yl)-2-(hydroxymethyl)oxolan-3-yl] 4-oxopentanoate
Molecular FormulaC15H19N5O5
Molecular Weight349.34
XLogP-0.8
Topological Polar Surface Area142
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count7
Heavy Atom Count25
Formal Charge0
Complexity507
SMILES
CC(=O)CCC(=O)O[C@H]1C[C@@H](O[C@@H]1CO)N2C=NC3=C(N=CN=C32)N
InChI
InChI=1S/C15H19N5O5/c1-8(22)2-3-12(23)25-9-4-11(24-10(9)5-21)20-7-19-13-14(16)17-6-18-15(13)20/h6-7,9-11,21H,2-5H2,1H3,(H2,16,17,18)/t9-,10+,11+/m0/s1
InChIKey
QMLRRPZLOJDYOV-HBNTYKKESA-N
Chemical Structure
2D Structure
2D structure of 3'-o-Levulinyl-2'-deoxyadenosine
CAS: 440327-45-7
CID: 11110869
Formula: C15H19N5O5
MW: 349.34
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight349.34
XLogP3-0.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count7
Exact Mass349.13861872
Monoisotopic Mass349.13861872
Topological Polar Surface Area142 Ų
Heavy Atom Count25
Formal Charge0
Complexity507
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

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NB163013-013’-O-tert-Butyldimethylsilyl-2’-deoxyadenosine
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