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Isocytidine

CAT: 0013-GTR19215473-03Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19215473-03Size:25 mg
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Description
This is a modified nucleoside analog of isocytidine, a synthetic cytosine derivative. It serves as a valuable research tool in nucleic acid chemistry, enzymology, and for studying nucleoside metabolism in both in vitro biochemical assays and cellular research models.
CAS Number
489-59-8
Field of Research
Cell Biology, Molecular Biology
Smiles
O[C@H]1[C@@H] (O[C@H] (CO) [C@H]1O) N2C (N) =NC (=O) C=C2
Molecular Formula
C9H13N3O5
Molecular Weight
243.22
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Isocytidine
CAS Number489-59-8
PubChem CID65031
IUPAC Name2-amino-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-4-one
Molecular FormulaC9H13N3O5
Molecular Weight243.22
XLogP-2.1
Topological Polar Surface Area129
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Heavy Atom Count17
Formal Charge0
Complexity383
SMILES
C1=CN(C(=NC1=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O
InChI
InChI=1S/C9H13N3O5/c10-9-11-5(14)1-2-12(9)8-7(16)6(15)4(3-13)17-8/h1-2,4,6-8,13,15-16H,3H2,(H2,10,11,14)/t4-,6-,7-,8-/m1/s1
InChIKey
RGNOTKMIMZMNRX-XVFCMESISA-N
Chemical Structure
2D Structure
2D structure of Isocytidine
CAS: 489-59-8
CID: 65031
Formula: C9H13N3O5
MW: 243.22
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight243.22
XLogP3-2.1
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass243.08552052
Monoisotopic Mass243.08552052
Topological Polar Surface Area129 Ų
Heavy Atom Count17
Formal Charge0
Complexity383
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

Related Products

CatalogName
GTR19250956Isocytosine

Alternative Products

CatalogName
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TNU0714-012',3'-Isopropylidene-isocytidine
ND763922'-Deoxy-5-methyl-isocytidine
TNU0203-013'-Deoxy-3'-azido-isocytidine
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