Products for Research Use Only

DdTTP-α-S

CAT: 1106-BLG-D029-25Size: 5x 5 μmoLDry Ice: YesHazardous: No
Product image 1
1 / 1
CAT#:1106-BLG-D029-25Size:5x 5 μmoL
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
154771-48-9
Product Name Alternative
2′,3′-Dideoxythymidine-5′-O- (1-thiotiphosphate) . tetrasodium salt, Rp-/Sp-isomers, Rp-/Sp-ddTTP-α-S
Certification
RUO
Type
Modified nucleotides
Purity
> 95% HPLC for mixture of Rp-/Sp-isomers
Molecular Formula
C 10 H 17 N 2 O 12 P 3 S (free acid)
Molecular Weight
482.2 (free acid)
Shipping Conditions
Dry Ice
Storage Conditions
-80°C
Notes
For the Original Manufacturer’s data sheet please click here .
Appearance
10 mM aqueous solution

Chemical Information

ddTTP-alpha-S
CAS Number154771-48-9
PubChem CID131701255
IUPAC Nametetrasodium;[[[(2S,5R)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-oxidophosphinothioyl]oxy-oxidophosphoryl] phosphate
Molecular FormulaC10H13N2Na4O12P3S
Molecular Weight570.16
Topological Polar Surface Area245
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count13
Rotatable Bond Count7
Heavy Atom Count32
Formal Charge0
Complexity807
SMILES
CC1=CN(C(=O)NC1=O)[C@H]2CC[C@H](O2)COP(=S)([O-])OP(=O)([O-])OP(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+]
InChI
InChI=1S/C10H17N2O12P3S.4Na/c1-6-4-12(10(14)11-9(6)13)8-3-2-7(22-8)5-21-27(20,28)24-26(18,19)23-25(15,16)17;;;;/h4,7-8H,2-3,5H2,1H3,(H,18,19)(H,20,28)(H,11,13,14)(H2,15,16,17);;;;/q;4*+1/p-4/t7-,8+,27?;;;;/m0..../s1
InChIKey
XYBYCGHHJGEUNT-PPIYBXBVSA-J
Chemical Structure
2D Structure
2D structure of ddTTP-alpha-S
CAS: 154771-48-9
CID: 131701255
Formula: C10H13N2Na4O12P3S
MW: 570.16
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight570.16
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count13
Rotatable Bond Count7
Exact Mass569.89928315
Monoisotopic Mass569.89928315
Topological Polar Surface Area245 Ų
Heavy Atom Count32
Formal Charge0
Complexity807
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count5
Compound Is CanonicalizedYes