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Details

Stereochemistry ABSOLUTE
Molecular Formula C14H15N7O6
Molecular Weight 377.3122
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-[4-(carboxy)-1H-pyrazol-1-yl]adenosine

SMILES

NC1=C2N=CN([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C2=NC(=N1)N4C=C(C=N4)C(O)=O

InChI

InChIKey=NLDXPPQYALPBFB-WOUKDFQISA-N
InChI=1S/C14H15N7O6/c15-10-7-11(19-14(18-10)21-2-5(1-17-21)13(25)26)20(4-16-7)12-9(24)8(23)6(3-22)27-12/h1-2,4,6,8-9,12,22-24H,3H2,(H,25,26)(H2,15,18,19)/t6-,8-,9-,12-/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
2-[4-(carboxy)-1H-pyrazol-1-yl]adenosine
Common Name English
1-(6-Amino-9-β-D-ribofuranosyl-9H-purin-2-yl)-1H-pyrazole-4-carboxylic acid
Systematic Name English
1H-Pyrazole-4-carboxylic acid, 1-(6-amino-9-β-D-ribofuranosyl-9H-purin-2-yl)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID201143936
Created by admin on Sat Dec 16 19:27:34 GMT 2023 , Edited by admin on Sat Dec 16 19:27:34 GMT 2023
PRIMARY
CAS
313348-29-7
Created by admin on Sat Dec 16 19:27:34 GMT 2023 , Edited by admin on Sat Dec 16 19:27:34 GMT 2023
PRIMARY
PUBCHEM
9864495
Created by admin on Sat Dec 16 19:27:34 GMT 2023 , Edited by admin on Sat Dec 16 19:27:34 GMT 2023
PRIMARY
FDA UNII
P84P8R975A
Created by admin on Sat Dec 16 19:27:34 GMT 2023 , Edited by admin on Sat Dec 16 19:27:34 GMT 2023
PRIMARY