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Details

Stereochemistry ACHIRAL
Molecular Formula C5H6N6
Molecular Weight 150.1413
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 8-Aminoadenine

SMILES

NC1=NC2=NC=NC(N)=C2N1

InChI

InChIKey=PFUVOLUPRFCPMN-UHFFFAOYSA-N
InChI=1S/C5H6N6/c6-3-2-4(9-1-8-3)11-5(7)10-2/h1H,(H5,6,7,8,9,10,11)

HIDE SMILES / InChI

Molecular Formula C5H6N6
Molecular Weight 150.1413
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
Target ID: UniProtKB - Q96LB0 (MRGX3_HUMAN)
6.51 µM [Ki]
PubMed

PubMed

TitleDatePubMed
Structure-activity relationships of adenine and deazaadenine derivatives as ligands for adenine receptors, a new purinergic receptor family.
2009-10-08
Substance Class Chemical
Created
by admin
on Wed Apr 02 12:02:07 GMT 2025
Edited
by admin
on Wed Apr 02 12:02:07 GMT 2025
Record UNII
G45ND69PRK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
8-Aminoadenine
Systematic Name English
NSC-21698
Preferred Name English
Purine, 6,8-diamino-
Systematic Name English
9H-Purine-6,8-diamine
Systematic Name English
1H-Purine-6,8-diamine
Systematic Name English
Code System Code Type Description
NSC
21698
Created by admin on Wed Apr 02 12:02:07 GMT 2025 , Edited by admin on Wed Apr 02 12:02:07 GMT 2025
PRIMARY
FDA UNII
G45ND69PRK
Created by admin on Wed Apr 02 12:02:07 GMT 2025 , Edited by admin on Wed Apr 02 12:02:07 GMT 2025
PRIMARY
EPA CompTox
DTXSID20402507
Created by admin on Wed Apr 02 12:02:07 GMT 2025 , Edited by admin on Wed Apr 02 12:02:07 GMT 2025
PRIMARY
PUBCHEM
4371597
Created by admin on Wed Apr 02 12:02:07 GMT 2025 , Edited by admin on Wed Apr 02 12:02:07 GMT 2025
PRIMARY
CAS
28128-33-8
Created by admin on Wed Apr 02 12:02:07 GMT 2025 , Edited by admin on Wed Apr 02 12:02:07 GMT 2025
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT