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UTP (αB)

CAT: 0804-HY-178646Size: 1 EachDry Ice: NoHazardous: No
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CAT#:0804-HY-178646Size:1 Each
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Description
UTP (αB) is a monomeric raw material that can be used for nucleic acid synthesis.
CAS Number
199116-90-0
UNSPSC
12352005
Target
Nucleoside Antimetabolite/Analog
Related Pathways
Cell Cycle/DNA Damage
Field of Research
Metabolic Disease
Smiles
O[C@H]1[C@@H](O)[C@H](N2C(NC(C=C2)=O)=O)O[C@@H]1COP(OP(OP(O)(O)=O)(O)=O)(B)=O
Molecular Formula
C9H16BN2O14P3
Molecular Weight
479.96
Shipping Conditions
Room temperature
Scientific Category
Oligonucleotides
Clinical Information
No Development Reported

Chemical Information

CID 101189544
CAS Number199116-90-0
PubChem CID101189544
Molecular FormulaC9H14BN2O14P3
Molecular Weight477.95
Topological Polar Surface Area245
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count14
Rotatable Bond Count8
Heavy Atom Count29
Formal Charge0
Complexity790
SMILES
[B][P+]([O-])(OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=CC(=O)NC2=O)O)O)OP(=O)(O)OP(=O)(O)O
InChI
InChI=1S/C9H14BN2O14P3/c10-27(17,25-29(21,22)26-28(18,19)20)23-3-4-6(14)7(15)8(24-4)12-2-1-5(13)11-9(12)16/h1-2,4,6-8,14-15H,3H2,(H,21,22)(H,11,13,16)(H2,18,19,20)/t4-,6-,7-,8-,27?/m1/s1
InChIKey
TWHPOHNQPMBICB-UJBMRLNCSA-N
Chemical Structure
2D Structure
2D structure of CID 101189544
CAS: 199116-90-0
CID: 101189544
Formula: C9H14BN2O14P3
MW: 477.95
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight477.95
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count14
Rotatable Bond Count8
Exact Mass477.9750943
Monoisotopic Mass477.9750943
Topological Polar Surface Area245 Ų
Heavy Atom Count29
Formal Charge0
Complexity790
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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