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3'-NH2-TTP

CAT: 0013-GTR19266947-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19266947-01Size:50 mg
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Description
3'-NH2-TTP is a nucleotide analog characterized by an amino modification at the 3' end of TTP.
CAS Number
99614-94-5
Field of Research
Cell Biology, Molecular Biology
Smiles
O[C@@H]1[C@@H] (O[C@H] (COP (OP (OP (=O) (O) O) (=O) O) (=O) O) [C@H]1N) N2C (=O) NC (=O) C (C) =C2
Molecular Formula
C10H18N3O14P3
Molecular Weight
497.18
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

[[(2S,3S,4S,5R)-3-amino-4-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
CAS Number99614-94-5
PubChem CID178203561
IUPAC Name[[(2S,3S,4S,5R)-3-amino-4-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
Molecular FormulaC10H18N3O14P3
Molecular Weight497.18
XLogP-8.3
Topological Polar Surface Area265
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count15
Rotatable Bond Count8
Heavy Atom Count30
Formal Charge0
Complexity886
SMILES
CC1=CN(C(=O)NC1=O)[C@H]2[C@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)N)O
InChI
InChI=1S/C10H18N3O14P3/c1-4-2-13(10(16)12-8(4)15)9-7(14)6(11)5(25-9)3-24-29(20,21)27-30(22,23)26-28(17,18)19/h2,5-7,9,14H,3,11H2,1H3,(H,20,21)(H,22,23)(H,12,15,16)(H2,17,18,19)/t5-,6-,7+,9-/m1/s1
InChIKey
VXDIIGACYIACFD-JAGXHNFQSA-N
Chemical Structure
2D Structure
2D structure of [[(2S,3S,4S,5R)-3-amino-4-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
CAS: 99614-94-5
CID: 178203561
Formula: C10H18N3O14P3
MW: 497.18
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight497.18
XLogP3-8.3
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count15
Rotatable Bond Count8
Exact Mass497.00016325
Monoisotopic Mass497.00016325
Topological Polar Surface Area265 Ų
Heavy Atom Count30
Formal Charge0
Complexity886
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