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C10H13N2Na4O14P3

HCID 101972017
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Basic information

CAS
3624-46-2
Standard SMILES
Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)([O-])OP(=O)(O)OP(=O)([O-])[O-])O2)c(=O)nc1[O-].[Na+].[Na+].[Na+].[Na+]
InChIKey
FOWRUVUUUBXRNF-ZKRIHRHSSA-J
Molecular formula
C10H13N2Na4O14P3
Average molar mass
570.1 g/mol
Monoisotopic mass
569.91704121

Names & identifiers

Preferred name
C10H13N2Na4O14P3
IUPAC
tetrasodium;[hydroxy-[[(2R,3S,5R)-3-hydroxy-5-(5-methyl-4-oxido-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-oxidophosphoryl]oxyphosphoryl] phosphate
English name
THYMIDINE 5'-TRIPHOSPHATE SODIUM SALT
Molecular formula
C10H18N2NaO14P3
Molecular weight
506.17

Names & synonyms

3624-46-2C10H13N2Na4O14P3FOWRUVUUUBXRNF-ZKRIHRHSSA-Jtetrasodium;[[[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methoxy-oxido-phosphoryl]oxy-oxido-phosphoryl] phosphateTTPDTTP NAdTTP,4NaDTTP, SODIUMDTTP SODIUM SALTTTP TRISODIUM SALTDTTP TRISODIUM SALTdTTP solution - Sodium Salt
Show more names
THYMIDINE 5'-TRIPHOSPHATE SODIUM SALT

Database identifiers

CAS
3624-46-2
PubChem CID
101972017
EC Number
222-826-2
Nikkaji
J205.550C

Properties

Computed structural properties

Topological polar surface area
254 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
14
Rotatable bonds
7
Heavy atoms
33
Formal charge
0
Complexity
846

Physicochemical properties

storage temp.
Sealed in dry,Room Temperature
CAS DataBase Reference
3624 · 3624-46-2(CAS DataBase Reference)
NCI Dictionary of Cancer Terms
TTP
Hazard Codes
Xi,Xn
Risk Statements
36 · 36/37/38-20/21/22
Safety Statements
26 · 26-36-24/25-22-37/39
WGK Germany
3 · 3
F
1 · 1-10

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

F
1-10
wgk
3
risk_code
36/37/38-20/21/22
hazard_code
Xi,Xn
safety_code
26-36-24/25-22-37/39

Related reactions

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Compound notes

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