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Cytidine triphosphate disodium salt

HCID 593
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
36051-68-0
Standard SMILES
Nc1ccn(C2OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)n1
InChIKey
PCDQPRRSZKQHHS-UHFFFAOYSA-N
Molecular formula
C9H16N3O14P3
Average molar mass
483.16 g/mol
Monoisotopic mass
482.98451208

Names & identifiers

Preferred name
Cytidine triphosphate disodium salt
IUPAC
[[5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
English name
Cytidine 5'-triphosphate disodium salt
Molecular formula
C9H17N3NaO14P3
Molecular weight
507.15

Names & synonyms

Ara-C triphosphateCytidine triphosphate disodium saltSCHEMBL15958751DTXSID20861610NSC20261[[5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphateNS00041321L0010914-Amino-1-[5-O-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)pentofuranosyl]pyrimidin-2(1H)-oneCTP DISODIUM SALTCTP.2NadTTP.Na2
Show more names
5′-CTP,2CTPNa.2H2OCTP, NA2H25′-CTP,2Na5'-CMP 2NA5'-CTP-Na2CTP –, Solid (1 g)

Database identifiers

CAS
36051-68-0
PubChem CID
593
DTXSID
DTXSID20861610

Properties

Computed structural propertiesFilling in

XLogP
-5.6
Topological polar surface area
268 Ų
Hydrogen bond donors
7
Hydrogen bond acceptors
14
Rotatable bonds
8
Heavy atoms
29
Formal charge
0
Complexity
855

Physicochemical properties

Flash point
113 °C · 113 °C
storage temp.
-20 °C · -20°C
solubility
2 O: · H2O: 50 mg/mL, clear, colorless
form
Powder
color
White
Water Solubility
Soluble in water. Insoluble in ethanol, chloroform and ether.
InChIKey
LGADHEWLYMMGHW-RFFBCSJBNA-N
SMILES
O[C@@H]1[C@@H]([C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@H]1N1C=CC(N)=NC1=O)O.[NaH] |&1:1,2,3,19,r|
CAS DataBase Reference
36051 · 36051-68-0(CAS DataBase Reference)
FDA UNII
7 D7ZF20MNG · 7D7ZF20MNG
UNSPSC Code
41106305 · 41106305
NACRES
77 · NA.77
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
315 · H315-H319-H335

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
10-21
PPE
Eyeshields, Gloves, type N95 (US)
wgk
3
hs_code
29349990
Signal word
Warning
Symbol(GHS)
GHS07
safety_code
24/25
Storage Class
11 - Combustible Solids
Hazard statements
H315-H319-H335
Precautionary statements
P261-P305+P351+P338

Chemistry & industry

Applications · 4 items

DescriptionCytidine 5'-triphosphate disodium salt is a nucleoside triphosphate with a pyrimidine ring, which is present in RNA. It is a nucleotide derivative and is involved in phospholipid anabolism in vivo. It can cross the blood-cerebrospinal fluid barrier. It is the intermediate product and energy source of cephalin synthesis and nucleic acid metabolism. It can also improve the stability and reconstruction ability of nerve cell membrane structure, support nerve cell survival, delay cell aging and death, and improve nerve cells. Injury resistance, promote neurite outgrowth.

UsesCytidine-5'-triphosphate disodium salt is a cation-permeable ligand gated ion channel (P2X purinergic receptor) agonist. It is also used as an organic intermediate, pharmaceutical intermediate, food additive and flavoring agent.

UsesCytidine 5'-triphosphate disodium salt is a pyrimidine nucleoside triphosphate salt that is involved in a variety of biochemical reactions. It is used in the synthesis of RNA by RNA polymerases. In the formation of phosphatidylcholine (PC), CTP reacts with phosphocholine, via CTP:phosphocholine cytidylyltransferases, to produce CDP-choline and diphosphate. This is the rate-limiting step in PC synthesis and, as a pivotal step in cell proliferation, can be important in cancer. CTP also interacts with N-acylneuraminate, in a reaction mediated by N-acylneuraminate cytidylyltransferase, to generate an intermediate that is required for sialylation, namely CMP-N-acylneuraminic acid.[Cayman Chemical]

General DescriptionCytidine 5′-triphosphate is a nucleoside triphosphate with a pyrimidine ring. It is present in RNA.

Related reactions

1 records
New reaction record
HRID 835499 reaction equation
HRID 835499As reactantTest data from https://doi.org/10.1039/C8SC04228D

Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
More actions
New noteNew reactionRequest quotes
Precautionary statements
261 · P261-P305+P351+P338
PPE
95 · Eyeshields, Gloves, type N95 (US)
Safety Statements
24 · 24/25
WGK Germany
3 · 3
F
10 · 10-21
HS Code
29349990 · 29349990
Storage Class
11 · 11 - Combustible Solids