2-[4-(carboxy)-1H-pyrazol-1-yl]adenosine

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

Structure Search

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

Molecular Formula	C14H15N7O6
Molecular Weight	377.3122
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 19:27:34 GMT 2023` Edited by `admin` on `Sat Dec 16 19:27:34 GMT 2023`
Record UNII	P84P8R975A
Record Status	`Validated (UNII)`
Record Version

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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

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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

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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

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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

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