(2s,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-n-methyloxolane-2-carboxamide (CED0167595)

Record Information

Version

1.0

Creation Date

2026-08-18 10:29:25 UTC

Update Date

2026-08-18 10:29:25 UTC

Accession Number

CHEM157120

Identification

Common Name

(2s,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-n-methyloxolane-2-carboxamide

Class

Small Molecule

Description

(2s,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-n-methyloxolane-2-carboxamide belongs to the purine nucleosides, a class of nucleosides, nucleotides, and analogues within the organic compounds. This compound has the chemical formula C11H14N6O4 and an average molecular weight of 294.27 g/mol. It has been found in or released from four recorded sources, including television systems, antennas, video games, and emergency protective devices, all of which fall under the category of electrical and electronic equipment.

Contaminant Type

Not Available

Chemical Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Chemical Formula

C₁₁H₁₄N₆O₄

Average Molecular Mass

294.270 g/mol

Monoisotopic Mass

294.108 g/mol

CAS Registry Number

35788-27-3

IUPAC Name

Not Available

Traditional Name

Not Available

SMILES

Not Available

InChI Identifier

InChI=1S/C11H14N6O4/c1-13-10(20)7-5(18)6(19)11(21-7)17-3-16-4-8(12)14-2-15-9(4)17/h2-3,5-7,11,18-19H,1H3,(H,13,20)(H2,12,14,15)/t5-,6+,7-,11+/m0/s1

InChI Key

PLYRYAHDNXANEG-QMWPFBOUSA-N

Chemical Taxonomy

Classification

Not classified

Biological Properties

Status

Detected and Not Quantified

Origin

Not Available

Cellular Locations

Not Available

Biofluid Locations

Not Available

Tissue Locations

Not Available

Applications

Not Available

Biological Roles

Not Available

Chemical Roles

Not Available

Organoleptic Effects

Not Available

Physical Properties

State

Not Available

Appearance

Not Available

Experimental Properties

Property	Value
Melting Point	Not Available
Boiling Point	Not Available
Solubility	Not Available

Predicted Properties

Not Available

Spectra

Not Available

Toxicity Profile

Mechanism of Toxicity

Not Available

Carcinogenicity (IARC Classification)

Not Available

Minimum Risk Level

Not Available

Symptoms

Not Available

Treatment

Not Available

Toxicity Values

Toxicity Value	Unit	Value Range	Organism	Dose Descriptor	Route of Exposure	Predicted or Experimental	Reference
1652.0	Log mg/kg	[930:2900]	Rat	LD50	oral	predicted	Not Available

Health Effects

Health Effect	Relationship	Direction	Reference

Exposure Sources

Source ID	Source	Sector	Reference
506	Antennas	Electrical & Electronic Equipment	Not Available
520	Emergency Protective Devices	Electrical & Electronic Equipment	Not Available
537	Television Systems	Electrical & Electronic Equipment	Not Available
539	Video Games	Electrical & Electronic Equipment	Not Available
612	Body Washing Or Cleaning Implements	Personal care & cosmetics	Not Available
630	Toys	Recreation & sports surfaces	Not Available
640	Embroidering And Tufting	Textiles, leather & furnishings	Not Available
647	Multicolour Dyeing	Textiles, leather & furnishings	Not Available
653	Sewing	Textiles, leather & furnishings	Not Available

Pathways

0 pathways

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets

Structure	Protein	UniProt ID	Organism	Relationship	Details
Click to view 3D structure	Heat shock protein HSP 90-alpha	P07900	Humans	Predicted (SEA)	0.622794
Click to view 3D structure	Endoplasmin	P14625	Humans	Predicted (SEA)	0.311397
Click to view 3D structure	Adenosine receptor A1	P25099	Rattus norvegicus	Predicted (SEA)	3.73676
Click to view 3D structure	2-oxoglutarate receptor 1	Q6Y1R5	Rattus norvegicus	Predicted (SEA)	0.311397
Click to view 3D structure	Adenosine receptor A3	P28647	Rattus norvegicus	Predicted (SEA)	2.33548
Click to view 3D structure	Adenosylhomocysteinase	P23526	Humans	Predicted (SEA)	0.155698
Click to view 3D structure	Endoplasmin	Q29092	Sus scrofa	Predicted (SEA)	0.622794
Click to view 3D structure	Adenosine receptor A3	P0DMS8	Humans	Predicted (SEA)	6.85073
Click to view 3D structure	Adenosine receptor A2a	P30543	Rattus norvegicus	Predicted (SEA)	3.50322
Click to view 3D structure	Adenosine receptor A2a	P29274	Humans	Predicted (SEA)	5.2159
Click to view 3D structure	Adenosine receptor A1	P30542	Humans	Predicted (SEA)	4.9045
Click to view 3D structure	5-hydroxytryptamine receptor 2A	P28223	Humans	Predicted (SEA)	21.0971
Click to view 3D structure	Adenosine receptor A2b	P29275	Humans	Predicted (SEA)	12.923
Click to view 3D structure	S-methyl-5'-thioadenosine phosphorylase	Q9CQ65	Mus musculus	Predicted (SEA)	2.02408
Click to view 3D structure	Adenosylhomocysteinase	P10760	Rattus norvegicus	Predicted (SEA)	0.778492
Click to view 3D structure	P2Y purinoceptor 1	P47900	Humans	Predicted (SEA)	7.47353
Click to view 3D structure	P2Y purinoceptor 2	P41231	Humans	Predicted (SEA)	7.08428
Click to view 3D structure	P2Y purinoceptor 1	P49652	Meleagris gallopavo	Predicted (SEA)	4.51525
Click to view 3D structure	Heat shock cognate 71 kDa protein	P19120	Bos taurus	Predicted (SEA)	4.12601
Click to view 3D structure	Sensor protein kinase WalK	Q9RDT3	Staphylococcus aureus	Predicted (SEA)	4.12601
Click to view 3D structure	Histone-arginine methyltransferase CARM1	Q86X55	Humans	Predicted (SEA)	4.43741
Click to view 3D structure	Histone-lysine N-methyltransferase, H3 lysine-79 specific	Q8TEK3	Humans	Predicted (SEA)	3.58106
Click to view 3D structure	P2X purinoceptor 1	P51575	Humans	Predicted (SEA)	4.35956
Click to view 3D structure	Adenosine receptor A1	P47745	Cavia porcellus	Predicted (SEA)	6.53933
Click to view 3D structure	P2X purinoceptor 3	P56373	Humans	Predicted (SEA)	4.35956