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Mant-dATP

CAT: 0013-GTR19152719Size: 5 x 50 ulDry Ice: NoHazardous: No
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CAT#:0013-GTR19152719Size:5 x 50 ul
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Description
Mant-dATP
CAS Number
128113-53-1
Product Name Alternative
3'-O- (N-Methyl-anthraniloyl) -2'-deoxyadenosine-5'-triphosphate, Triethylammonium salt
Concentration
10 mM-11 mM
Purity
≥ 95% (HPLC)
Form
Solution in water; Color: colorless to slightly yellow; pH: 7.5 ± 0.5
Smiles
C (=O) (c1ccccc1NC) O[C@@H]1[C@@H] (COP (=O) (O) OP (=O) (O) OP (=O) (O) O) O[C@@H] (n2cnc3c (N) ncnc23) C1
Molecular Formula
C18H23N6O13P3
Molecular Weight
Theoretical MW: 624.33 g/mol (free acid) ; Detected MW: 624.05 g/mol (free acid)
Storage Conditions
Store at -20 °C
Notes
For research use only.
Applications Notes
Spectroscopic Propertie: λmax 255/355 nm, ε 23.3/5.8 L mmol-1 cm-1, (Tris-HCl pH 7.5), λexc 355 nm, λem 448 nm.

Chemical Information

3'-O-(N-Methylanthraniloyl)-dATP
CAS Number128113-53-1
PubChem CID44444983
IUPAC Name[(2R,3S,5R)-5-(6-aminopurin-9-yl)-2-[[hydroxy-[hydroxy(phosphonooxy)phosphoryl]oxyphosphoryl]oxymethyl]oxolan-3-yl] 2-(methylamino)benzoate
Molecular FormulaC18H23N6O13P3
Molecular Weight624.3
XLogP-2
Topological Polar Surface Area277
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count18
Rotatable Bond Count12
Heavy Atom Count40
Formal Charge0
Complexity1050
SMILES
CNC1=CC=CC=C1C(=O)O[C@H]2C[C@@H](O[C@@H]2COP(=O)(O)OP(=O)(O)OP(=O)(O)O)N3C=NC4=C(N=CN=C43)N
InChI
InChI=1S/C18H23N6O13P3/c1-20-11-5-3-2-4-10(11)18(25)35-12-6-14(24-9-23-15-16(19)21-8-22-17(15)24)34-13(12)7-33-39(29,30)37-40(31,32)36-38(26,27)28/h2-5,8-9,12-14,20H,6-7H2,1H3,(H,29,30)(H,31,32)(H2,19,21,22)(H2,26,27,28)/t12-,13+,14+/m0/s1
InChIKey
ALFDGDVXGBEMIN-BFHYXJOUSA-N
Chemical Structure
2D Structure
2D structure of 3'-O-(N-Methylanthraniloyl)-dATP
CAS: 128113-53-1
CID: 44444983
Formula: C18H23N6O13P3
MW: 624.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight624.3
XLogP3-2
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count18
Rotatable Bond Count12
Exact Mass624.05359580
Monoisotopic Mass624.05359580
Topological Polar Surface Area277 Ų
Heavy Atom Count40
Formal Charge0
Complexity1050
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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Alternative Products

CatalogName
NU-203LMant-dATP
NU-223L2'-Mant-3'-dATP
JBS-NU-203SMant-dATP, S pack
JBS-NU-203LMant-dATP, L pack
NU-835-MNTN6- (6-Aminohexyl) -dATP-MANT
NU-1611-MNT7-Propargylamino-7-deaza-dATP-MANT
JBS-NU-223S2′-Mant-3′-dATP, S pack
JBS-NU-835-MNTN6- (6-Amino) hexyl-dATP – MANT
JBS-NU-1611-MNT7-Propargylamino-7-deaza-dATP – MANT
JBS-NU-223L2′-Mant-3′-dATP, L pack

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