Sodium (4aR,6R,7R,7aR)-6-[6-(butyrylamino)-9H-purin-9-yl]-7-(butyryloxy)tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-2-olate 2-oxide

Basic Information

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CAS Number

16980-89-5

Molecular Formula

C18H23N5NaO8P

Molecular Weight

491.4 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Agricultural Chemicals Pesticides Insecticides

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Solubility

H2O: 50 mg/mL

SMILES

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CCCC(=O)NC1=C2C(=NC=N1)N(C=N2)C3C(C4C(O3)COP(=O)(O4)[O-])OC(=O)CCC.[Na+]

InChI

InChI=1S/C18H24N5O8P.Na/c1-3-5-11(24)22-16-13-17(20-8-19-16)23(9-21-13)18-15(30-12(25)6-4-2)14-10(29-18)7-28-32(26,27)31-14;/h8-10,14-15,18H,3-7H2,1-2H3,(H,26,27)(H,19,20,22,24);/q;+1/p-1/t10-,14-,15-,18-;/m1./s1

InChIKey

KRBZRVBLIUDQNG-JBVYASIDSA-M

LogP

2.20120

Complexity

765

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Sensitiveness

对热敏感

Synonyms & References

English

N6,2'-O-Dibutyryladenosine 3',5'-cyclic monophosphate sodium salt, >=97% (HPLC), powder
MLS002207119
N6,2'-O-Dibutyryladenosine 3',5'-cyclic monophosphate sodium salt, >=96% (HPLC), powder
Adenosine, N-(1-oxobutyl)-, cyclic 3',5'-(hydrogen phosphate)-2'-butanoate, monosodium salt
Actosin (TN)
N6,2'-O-DIBUTYRYLADENOSINE-3',5'-CYCLIC MONOPHOSPHATE SODIUM SALT
Bucladesine sodium (JAN)
DBcAMP.Na
Sodium dibutyryl cyclic adenosine-3',5'-monophosphate
N6,O2'-Dibutyryl adenosine 3',5'-cyclic monophosphate sodium salt
HY-B0764
Sodium dibutyryl cAMP
Bucladesine sodium [JAN]
Adenosine 3',5'-cyclic Monophosphate, N,O2'-Dibutyryl-, Sodium Salt - CAS 16980-89-5
Actosin
Opera_ID_1706
4DZN2C97A7
MLS006010661
N-(9-.BETA.-D-RIBOFURANOSYL-9H-PURIN-6-YL)BUTYRAMIDE CYCLIC 3',5'-(HYDROGEN PHOSPHATE) 2'-BUTYRATE SODIUM
Monosodium dibutyryl cyclic AMP
MLS000028684
N6,O2'-Dibutyry cyclic AMP, sodium salt
BP-58715
HMS2231C19
N6,2'-O-Dibutyryladenosine 3',5'-cyclic monophosphate sodium salt
Dibutyl cyclic AMP sodium
Adenosine, N-(1-oxobutyl)-, cyclic 3',5'-(hydrogen phosphate) 2'-butanoate, monosodium salt
Dibutyl cyclic AMP sodium salt
D01238
Dibutyryl-cAMP sodium salt
EINECS 241-059-4

MDL Number

MFCD00149371

FAQ

What is Sodium (4aR,6R,7R,7aR)-6-[6-(butyrylamino)-9H-purin-9-yl]-7-(butyryloxy)tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-2-olate 2-oxide (CAS: 16980-89-5)?

Sodium (4aR,6R,7R,7aR)-6-[6-(butyrylamino)-9H-purin-9-yl]-7-(butyryloxy)tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-2-olate 2-oxide (CAS: 16980-89-5) is a complex organic compound with a unique structure containing a purine ring and a dioxaphosphinine ring. It exhibits specific chemical properties and is often used in specialized chemical applications. Its molecular formula is C17H25N5O10PNa, and it is typically characterized by its solubility in polar solvents and stability under controlled conditions.

What are the main uses of Sodium (4aR,6R,7R,7aR)-6-[6-(butyrylamino)-9H-purin-9-yl]-7-(butyryloxy)tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-2-olate 2-oxide (CAS: 16980-89-5)?

This compound is primarily used in pharmaceutical research for its potential biological activity, particularly in the development of drugs targeting specific metabolic pathways. It may also find applications in organic synthesis and as a reagent in chemical research. Its unique structure makes it valuable for studying enzyme interactions and drug design. Search terms like 'purine derivative' and 'dioxaphosphinine compound' are relevant for its chemical classification.

Is Sodium (4aR,6R,7R,7aR)-6-[6-(butyrylamino)-9H-purin-9-yl]-7-(butyryloxy)tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-2-olate 2-oxide (CAS: 16980-89-5) safe?

The safety of this compound depends on its handling and exposure conditions. As a chemical compound, it may have potential toxicity if ingested or inhaled, so proper protective measures such as gloves and ventilation should be used. It is generally considered safe when handled according to standard chemical safety protocols. Safety data sheets and regulatory guidelines should be consulted for detailed information.

How should Sodium (4aR,6R,7R,7aR)-6-[6-(butyrylamino)-9H-purin-9-yl]-7-(butyryloxy)tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-2-olate 2-oxide (CAS: 16980-89-5) be stored?

This compound should be stored in a cool, dry, and dark place to maintain its stability. It is recommended to keep it in a sealed container at a temperature below 25°C and avoid exposure to moisture and light. Proper storage conditions are crucial for preserving its chemical integrity and ensuring safe handling. Search terms like 'chemical storage' and 'compound stability' are important for related queries.