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Home/Compounds/CAS 4754-39-6
Formula C10H13N5O3MW 251.24Research-use catalog entryCOA/SDS by request

5'-Deoxyadenosine

CAS Number: 4754-39-6

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Purity
98%
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250 mg
Purity
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Loading RDKit molecule structure...
InChIKey: XGYIMTFOTBMPFP-KQYNXXCUSA-NC10H13N5O3 | MW 251.24

Chemical Absolute Identifiers

CAS Number

4754-39-6

PubChem CID

439182

Molecular Formula

C10H13N5O3

Molecular Weight

251.24 g/mol

Exact Mass

251.101839

InChIKey

XGYIMTFOTBMPFP-KQYNXXCUSA-N

IUPAC Name

(2R,3R,4S,5R)-2-(6-aminopurin-9-yl)-5-methyloxolane-3,4-diol

SMILES String

C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O

Physical Properties

Melting Point

213–214.5 °C

Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.

Catalog Facts

Structural features

5'-Deoxyadenosine (CAS 4754-39-6) is listed in the Advanced Chemicals portfolio, with molecular formula C10H13N5O3 and molecular weight 251. 24 g/mol.

Sourcing context

Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.

Research use context

Intended for research building-block and synthetic chemistry workflows; structure-derived tags include nitrogen-containing heterocycle.

Documentation needs

COA/SDS status, availability, lead time, pack size, and shipment documentation can be confirmed during quotation.

Applications & Classification

Chemical BiologySynthetic ChemistryResearch intermediateCustom synthesis building blockResearch chemical sourcingCustom synthesis and catalog availability reviewCOA, SDS, pricing, and fulfillment workflow
Biological target reference

ChEMBL reports experimental activity evidence for: Adenosine receptor A3 (Homo sapiens) — 3 assays; Adenosine receptor A1 (Rattus norvegicus) — 3 assays; S-methyl-5'-thioadenosine phosphorylase (Homo sapiens) — 3 assays. These records describe research assays and do not establish therapeutic efficacy or clinical use.

Adenosine receptor A3

Homo sapiens · SINGLE PROTEIN · 3 qualifying assays · 1 documents · best pChEMBL 6.66

Experimental evidence source: ChEMBL

Adenosine receptor A1

Rattus norvegicus · SINGLE PROTEIN · 3 qualifying assays · 2 documents · best pChEMBL 6.57

Experimental evidence source: ChEMBL

S-methyl-5'-thioadenosine phosphorylase

Homo sapiens · SINGLE PROTEIN · 3 qualifying assays · 1 documents

Experimental evidence source: ChEMBL

Safety & Handling

Safety and handling reference content is available through documentation requests.

For supplier-issued SDS, request documentation before handling, storage, shipment, or procurement decisions.

Preliminary Safety Reference

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Safety Reference / SDS Request

Names & Synonyms / External Identifiers

Chemical Name

5'-Deoxyadenosine

Names & Synonyms

ADENOSINE, 5'-DEOXY-(2R,3R,4S,5R)-2-(6-amino-9H-purin-9-yl)-5-methyloxolane-3,4-diol5'-DAdo nucleoside(2R,3R,4S,5R)-2-(6-Amino-9H-purin-9-yl)-5-methyltetrahydrofuran-3,4-diol5 inverted exclamation marka-Deoxyadenosine
Show all synonyms
5AD(2R,3R,4S,5R)-2-(6-aminopurin-9-yl)-5-methyl-tetrahydrofuran-3,4-diol5?-Deoxyadenosine5'-deoxy-adenosineCH3Ado5''-Deoxyadenosine5a(2)-Deoxyadenosine5''''-Deoxyadenosine4-26-00-03588 (Beilstein Handbook Reference)5'-DEOXY-D-ADENOSINE5'-DOAAdenosine, 5'-deoxy- (6CI,7CI,8CI,9CI)(2R,3S,4S,5R)-2-(6-AMINOPURIN-9-YL)-5-METHYL-OXOLANE-3,4-DIOL(2R3R4S5R)-2-(6-amino-9H-purin-9-yl)-5-methyltetrahydrofuran-34-diol
External Identifiers
DSSTOX SUBSTANCE ID: DTXSID901036031CHEMBL ID: CHEMBL443485CHEBI ID: CHEBI:17319UNII: 2U0TYC8Y5AHMDB ID: HMDB0001983KEGG ID: C05198METABOLOMICS WORKBENCH ID: 37963WIKIDATA ID: Q27102319
Experimental Spectrum References
13C NMR Spectra — Sigma-Aldrich Co. LLC.1H NMR Spectra — Sigma-Aldrich Co. LLC.
Literature & Patent References
DOI 10.1021/acsmedchemlett.4c00522Synthesis and Biological Evaluation of 5'-Deoxy-adenosine Derivatives as A<sub>3</sub> Adenosine Receptor Ligands.PMID 39811127Synthesis and Biological Evaluation of 5'-Deoxy-adenosine Derivatives as A<sub>3</sub> Adenosine Receptor Ligands.DOI 10.1021/acs.jmedchem.5b02001Exploiting Protein Conformational Change to Optimize Adenosine-Derived Inhibitors of HSP70.PMID 27119979Exploiting Protein Conformational Change to Optimize Adenosine-Derived Inhibitors of HSP70.DOI 10.1016/j.bmcl.2005.03.107Design, synthesis, and biological evaluation of novel human 5'-deoxy-5'-methylthioadenosine phosphorylase (MTAP) substrates.PMID 15911263Design, synthesis, and biological evaluation of novel human 5'-deoxy-5'-methylthioadenosine phosphorylase (MTAP) substrates.DOI 10.1021/jm960770eCarbocyclic oxetanocins lacking the C-3' methylene.PMID 9135038Carbocyclic oxetanocins lacking the C-3' methylene.

Documentation & Compliance Facts

Compliance Facts

Shipment review: Required

Documentation available by request

Certificate of Analysis (COA): By request

Supplier Safety Data Sheet (SDS): By request

Purity and pack size confirmation: By request

Availability and lead time review: Confirmed by RFQ

Shipment documentation review: By request

For supplier-issued documentation by request, use the RFQ actions on this page.Review preliminary safety reference

What happens after RFQ

  1. 1We review the CAS identity, quantity, and documentation request.
  2. 2We check sourcing options, supplier availability, COA/SDS, purity, pack size, and lead time.
  3. 3We review destination and shipment documentation needs when applicable.
  4. 4We follow up with a quotation or clarification request.

Text Reference Cues

Show non-linked catalog cues

Non-public related references

3'-Amino-3'-deoxyadenosineCAS 2504-55-4
8-AzaadenosineCAS 10299-44-2
Acetylpyridine adenine dinucleotideCAS 86-08-8
[(2R,3S,4R,5R)-3,4-dihydroxy-5-(6-oxo-3H-purin-9-yl)oxolan-2-yl]methyl dihydrogen phosphateCAS 131-99-7
5'-Amino-5'-deoxyguanosineCAS 4099-84-7

Non-public references are shown as text only and do not imply equivalence, availability, or shared use.

Catalog navigation

Related Catalog Entries

Other public CAS pages in this catalog. These links support navigation across additional intermediates and do not imply equivalence, availability, or shared use.

CAS 2504-55-43'-Amino-3'-deoxyadenosineCAS 10299-44-28-AzaadenosineCAS 102146-07-6DpcpxCAS 155270-99-8IstradefyllineCAS 21829-25-4NifedipineCAS 1002310-00-0Tert-butyl 1-(2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)ethylcarbamateCAS 1005174-17-3(E)-3-(2-Propyl-6-(trifluoromethyl)pyridin-3-yl)acrylic acidCAS 1018125-49-92-(3-Cyclopropyl-6-ethyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acidCAS 1018128-07-8Isopropyl 4-chloro-2-methylquinoline-6-carboxylateCAS 1018142-22-76-cyclopropyl-1-(2,2-difluoroethyl)-3-methyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid

RFQ questions for CAS 4754-39-6

What are the key identifiers for 5'-Deoxyadenosine (CAS 4754-39-6)?

5'-Deoxyadenosine is identified by CAS 4754-39-6, with molecular formula C10H13N5O3, molecular weight 251.24, InChIKey XGYIMTFOTBMPFP-KQYNXXCUSA-N.

Does CAS 4754-39-6 have reported biological target evidence?

ChEMBL contains qualifying experimental assay evidence associated with Adenosine receptor A3, Adenosine receptor A1, S-methyl-5'-thioadenosine phosphorylase. These records do not establish therapeutic efficacy or clinical use.

Can I request a COA for CAS 4754-39-6?

Yes. Submit an RFQ and specify COA requirements. Lot-specific COA depends on supplier confirmation.

Can I request supplier SDS for 5'-Deoxyadenosine?

Yes. Supplier SDS can be requested through the RFQ workflow before handling, storage, shipment, or procurement decisions.

Is CAS 4754-39-6 available for quotation?

Availability, pack size, lead time, and pricing are confirmed through RFQ.

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