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Dihydro-5-azacytidine

CAT: 0013-GTR19188905Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19188905Size:25 mg
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Description
Dihydro-5-azacytidine
CAS Number
62488-57-7
Field of Research
Cell Biology, Epigenetics & Chromatin, Molecular Biology
Purity
>99.99% (May vary between batches)
Smiles
O[C@H]1[C@@H] (O[C@H] (CO) [C@H]1O) N2C (=O) N=C (N) NC2
Molecular Formula
C8H14N4O5
Molecular Weight
246.22
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Dihydro-5-azacytidine

5,6-dihydro-5-azacytidine is a white powder. (NTP, 1992)

CAS Number62488-57-7
PubChem CID99681
IUPAC Name6-amino-3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,4-dihydro-1,3,5-triazin-2-one
Molecular FormulaC8H14N4O5
Molecular Weight246.22
XLogP-3
Topological Polar Surface Area141
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Heavy Atom Count17
Formal Charge0
Complexity349
SMILES
C1N=C(NC(=O)N1[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O)N
InChI
InChI=1S/C8H14N4O5/c9-7-10-2-12(8(16)11-7)6-5(15)4(14)3(1-13)17-6/h3-6,13-15H,1-2H2,(H3,9,10,11,16)/t3-,4-,5-,6-/m1/s1
InChIKey
LJIRBXZDQGQUOO-KVTDHHQDSA-N
Chemical Structure
2D Structure
2D structure of Dihydro-5-azacytidine
CAS: 62488-57-7
CID: 99681
Formula: C8H14N4O5
MW: 246.22
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight246.22
XLogP3-3
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Exact Mass246.09641956
Monoisotopic Mass246.09641956
Topological Polar Surface Area141 Ų
Heavy Atom Count17
Formal Charge0
Complexity349
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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