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2'-Deoxy-5-hydroxyuridine 5'-triphosphate

CAT: 0926-ND168484Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0926-ND168484Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
27972-89-0
Smiles
C1C (C (OC1N2C=C (C (=O) NC2=O) O) COP (=O) (O) OP (=O) (O) OP (=O) (O) O) O
Controlled
No

Chemical Information

2'-Deoxy-5-hydroxyuridine triphosphate
CAS Number27972-89-0
PubChem CID20758492
IUPAC Name[(2R,3S,5R)-3-hydroxy-5-(5-hydroxy-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl [hydroxy(phosphonooxy)phosphoryl] hydrogen phosphate
Molecular FormulaC9H15N2O15P3
Molecular Weight484.14
XLogP-5.5
Topological Polar Surface Area259
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count15
Rotatable Bond Count8
Heavy Atom Count29
Formal Charge0
Complexity852
SMILES
C1[C@@H]([C@H](O[C@H]1N2C=C(C(=O)NC2=O)O)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O
InChI
InChI=1S/C9H15N2O15P3/c12-4-1-7(11-2-5(13)8(14)10-9(11)15)24-6(4)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h2,4,6-7,12-13H,1,3H2,(H,19,20)(H,21,22)(H,10,14,15)(H2,16,17,18)/t4-,6+,7+/m0/s1
InChIKey
RLYLTZXYBNQTOL-UBKIQSJTSA-N
Chemical Structure
2D Structure
2D structure of 2'-Deoxy-5-hydroxyuridine triphosphate
CAS: 27972-89-0
CID: 20758492
Formula: C9H15N2O15P3
MW: 484.14
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight484.14
XLogP3-5.5
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count15
Rotatable Bond Count8
Exact Mass483.96852877
Monoisotopic Mass483.96852877
Topological Polar Surface Area259 Ų
Heavy Atom Count29
Formal Charge0
Complexity852
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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