Tripyrrolidin-1-yl(triazolo[4,5-b]pyridin-3-yloxy)phosphanium (CED0260443)

Record Information

Version

1.0

Creation Date

2026-08-29 03:59:27 UTC

Update Date

2026-08-29 03:59:27 UTC

SynCED ID

CED0260443

Secondary Accession Numbers

CHEM305341

Identification

Common Name

Tripyrrolidin-1-yl(triazolo[4,5-b]pyridin-3-yloxy)phosphanium

Class

Small Molecule

Description

Tripyrrolidin-1-yl(triazolo[4,5-b]pyridin-3-yloxy)phosphanium is a compound with the formula C17H27N7OP+. It has an average molecular weight of 376.40 g/mol.

Contaminant Type

Not Available

Chemical Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Chemical Formula

C₁₇H₂₇N₇OP+

Average Molecular Mass

Not Available

Monoisotopic Mass

376.201 g/mol

CAS Registry Number

Not Available

IUPAC Name

Not Available

Traditional Name

Not Available

SMILES

C1CCN(C1)[P+](N2CCCC2)(N3CCCC3)ON4C5=C(C=CC=N5)N=N4

InChI Identifier

InChI=1S/C17H27N7OP/c1-2-11-21(10-1)26(22-12-3-4-13-22,23-14-5-6-15-23)25-24-17-16(19-20-24)8-7-9-18-17/h7-9H,1-6,10-15H2/q+1

InChI Key

NZFCFINYMZDNDL-UHFFFAOYSA-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

Toxicity Values

Toxicity Value	Organism	Dose Descriptor	Route of Exposure	Predicted or Experimental	Toxicity Rating	Reference
300.0 Log mg/kg [170:530]	Rat	LD50	oral	predicted	Not Available	Not Available

Toxicity / Toxin Class

Not Available

Mechanism of Toxicity

Not Available

Carcinogenicity (IARC Classification)

Not Available

Minimum Risk Level

Not Available

Symptoms

Not Available

Treatment

Not Available

Health Effects

Health Effect	Relationship	Direction	Description	Reference

Exposure Sources

Source ID	Source	Sector	Reference
CEDs000537	Television Systems?Television systems can be a source of synthetic chemical contamination due to the various materials and components used in their manufacture and operation.	Electrical & Electronic Equipment	PubChem
CEDs000602	Molluscicides?Molluscicides are synthetic chemicals specifically designed to control and eliminate mollusks, such as snails and slugs, which can be detrimental to crops and agricultural productivity.	Agriculture & land management	PubChem
CEDs000603	Nematocides?Nematocides are synthetic chemicals specifically designed to control nematodes, which are microscopic roundworms that can cause significant damage to crops and plants.	Agriculture & land management	PubChem
CEDs000696	Nanotechnology?Nanotechnology involves the manipulation of materials at the molecular or atomic level, typically within the range of 1 to 100 nanometers.	Industrial manufacturing & chemical processing	PubChem

Pathways

0 pathwaysPathway Source: PathBank

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	Cytochrome P450 2D6	P10635	Humans	Predicted (SEA)	Prediction Confidence Score 0.232 Applicability Domain 0.25 Low confidence Statistical Significance 0.6711 Supporting Reference Compounds 1130 E-value 5224.77
Click to view 3D structure	D(2) dopamine receptor	P14416	Humans	Predicted (SEA)	Prediction Confidence Score 0.227 Applicability Domain 0.265 Low confidence Statistical Significance 0.5312 Supporting Reference Compounds 1103 E-value 4135.12
Click to view 3D structure	Histamine H3 receptor	Q9Y5N1	Humans	Predicted (SEA)	Prediction Confidence Score 0.227 Applicability Domain 0.265 Low confidence Statistical Significance 0.2499 Supporting Reference Compounds 294 E-value 1945.14
Click to view 3D structure	5-hydroxytryptamine receptor 1A	P08908	Humans	Predicted (SEA)	Prediction Confidence Score 0.224 Applicability Domain 0.254 Low confidence Statistical Significance 0.5344 Supporting Reference Compounds 953 E-value 4159.95
Click to view 3D structure	Short transient receptor potential channel 4	Q9QUQ5	Mus musculus	Predicted (SEA)	Prediction Confidence Score 0.224 Applicability Domain 0.245 Low confidence Statistical Significance 0.1995 Supporting Reference Compounds 128 E-value 1553.48
Click to view 3D structure	Cytochrome P450 2B11	P24460	Canis lupus familiaris	Predicted (SEA)	Prediction Confidence Score 0.222 Applicability Domain 0.222 Low confidence Statistical Significance 0.0039 Supporting Reference Compounds 1 E-value 30.3612
Click to view 3D structure	Voltage-gated inwardly rectifying potassium channel KCNH2	Q12809	Humans	Predicted (SEA)	Prediction Confidence Score 0.222 Applicability Domain 0.238 Low confidence Statistical Significance 0.8337 Supporting Reference Compounds 1498 E-value 6490.37
Click to view 3D structure	ATP-dependent molecular chaperone HSP82	C4YTQ8	Candida albicans (strain WO-1) (Yeast)	Predicted (SEA)	Prediction Confidence Score 0.221 Applicability Domain 0.262 Low confidence Statistical Significance 0.2072 Supporting Reference Compounds 205 E-value 1613.27
Click to view 3D structure	5-hydroxytryptamine receptor 2C	P28335	Humans	Predicted (SEA)	Prediction Confidence Score 0.221 Applicability Domain 0.254 Low confidence Statistical Significance 0.5781 Supporting Reference Compounds 823 E-value 4500.31
Click to view 3D structure	D(4) dopamine receptor	P21917	Humans	Predicted (SEA)	Prediction Confidence Score 0.22 Applicability Domain 0.233 Low confidence Statistical Significance 0.4542 Supporting Reference Compounds 524 E-value 3536.07
Click to view 3D structure	Nonstructural protein 1	Q194T2	Influenza A virus	Predicted (SEA)	Prediction Confidence Score 0.216 Applicability Domain 0.233 Low confidence Statistical Significance 0.0794 Supporting Reference Compounds 104 E-value 617.889
Click to view 3D structure	Cytochrome P450 2C9	P11712	Humans	Predicted (SEA)	Prediction Confidence Score 0.214 Applicability Domain 0.235 Low confidence Statistical Significance 0.871 Supporting Reference Compounds 1245 E-value 6780.59
Click to view 3D structure	Cytochrome P450 1A2	P05177	Humans	Predicted (SEA)	Prediction Confidence Score 0.214 Applicability Domain 0.235 Low confidence Statistical Significance 0.7819 Supporting Reference Compounds 793 E-value 6087.34
Click to view 3D structure	Cytochrome P450 2C19	P33261	Humans	Predicted (SEA)	Prediction Confidence Score 0.213 Applicability Domain 0.235 Low confidence Statistical Significance 0.8015 Supporting Reference Compounds 825 E-value 6239.3
Click to view 3D structure	Cytochrome P450 3A4	P08684	Humans	Predicted (SEA)	Prediction Confidence Score 0.213 Applicability Domain 0.235 Low confidence Statistical Significance 0.895 Supporting Reference Compounds 1538 E-value 6967.43
Click to view 3D structure	Mitogen-activated protein kinase HOG1	P32485	Saccharomyces cerevisiae (strain ATCC 204508 / S288c) (Baker's yeast)	Predicted (SEA)	Prediction Confidence Score 0.212 Applicability Domain 0.212 Low confidence Statistical Significance 0.014 Supporting Reference Compounds 1 E-value 109.378
Click to view 3D structure	D(3) dopamine receptor	P35462	Humans	Predicted (SEA)	Prediction Confidence Score 0.211 Applicability Domain 0.217 Low confidence Statistical Significance 0.6701 Supporting Reference Compounds 861 E-value 5216.52
Click to view 3D structure	D(4) dopamine receptor	P30729	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.21 Applicability Domain 0.233 Low confidence Statistical Significance 0.1846 Supporting Reference Compounds 92 E-value 1437.02
Click to view 3D structure	5-hydroxytryptamine receptor 1B	P28564	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.21 Applicability Domain 0.254 Low confidence Statistical Significance 0.248 Supporting Reference Compounds 154 E-value 1931.05
Click to view 3D structure	Sodium-dependent serotonin transporter	P31645	Humans	Predicted (SEA)	Prediction Confidence Score 0.21 Applicability Domain 0.265 Low confidence Statistical Significance 0.6108 Supporting Reference Compounds 593 E-value 4755.26
Click to view 3D structure	Cyclin-dependent kinase 2	P24941	Humans	Predicted (SEA)	Prediction Confidence Score 0.21 Applicability Domain 0.25 Low confidence Statistical Significance 0.7718 Supporting Reference Compounds 1029 E-value 6008.09
Click to view 3D structure	3',5'-cyclic-AMP phosphodiesterase 4D	Q08499	Humans	Predicted (SEA)	Prediction Confidence Score 0.209 Applicability Domain 0.222 Low confidence Statistical Significance 0.3511 Supporting Reference Compounds 170 E-value 2733.52
Click to view 3D structure	Sigma non-opioid intracellular receptor 1	Q99720	Humans	Predicted (SEA)	Prediction Confidence Score 0.209 Applicability Domain 0.23 Low confidence Statistical Significance 0.6255 Supporting Reference Compounds 562 E-value 4869.78
Click to view 3D structure	5-hydroxytryptamine receptor 2A	P28223	Humans	Predicted (SEA)	Prediction Confidence Score 0.209 Applicability Domain 0.217 Low confidence Statistical Significance 0.74 Supporting Reference Compounds 955 E-value 5760.92
Click to view 3D structure	Streptokinase A	P10520	Streptococcus pyogenes serotype M1	Predicted (SEA)	Prediction Confidence Score 0.209 Applicability Domain 0.233 Low confidence Statistical Significance 0.5023 Supporting Reference Compounds 425 E-value 3910.29