2-(M-NITROPHENYL)ADENOSINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C16H16N6O6
Molecular Weight	388.3348
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

NC1=NC(=NC2=C1N=CN2[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C4=CC(=CC=C4)[N+]([O-])=O

InChI

InChIKey=ACAOMVAOUMITTJ-UBEDBUPSSA-N

InChI=1S/C16H16N6O6/c17-13-10-15(20-14(19-13)7-2-1-3-8(4-7)22(26)27)21(6-18-10)16-12(25)11(24)9(5-23)28-16/h1-4,6,9,11-12,16,23-25H,5H2,(H2,17,19,20)/t9-,11-,12-,16-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C16H16N6O6
Molecular Weight	388.3348
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 `Mon Mar 31 21:51:16 GMT 2025` Edited by `admin` on `Mon Mar 31 21:51:16 GMT 2025`
Record UNII	39890S3IGM
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(2R,3R,4S,5R)-2-(6-AMINO-2-(3-NITROPHENYL)PURIN-9-YL)-5-(HYDROXYMETHYL)OXOLANE-3,4-DIOL

Preferred Name

English

2-(M-NITROPHENYL)ADENOSINE

Systematic Name

English

ADENOSINE, 2-(3-NITROPHENYL)-

Systematic Name

English

2-(3-NITROPHENYL)ADENOSINE

Systematic Name

English

Code System Code Type Description

FDA UNII

39890S3IGM

Created by admin on Mon Mar 31 21:51:16 GMT 2025 , Edited by admin on Mon Mar 31 21:51:16 GMT 2025

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PUBCHEM

122998

Created by admin on Mon Mar 31 21:51:16 GMT 2025 , Edited by admin on Mon Mar 31 21:51:16 GMT 2025

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CAS

109875-47-0

Created by admin on Mon Mar 31 21:51:16 GMT 2025 , Edited by admin on Mon Mar 31 21:51:16 GMT 2025

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EPA CompTox

DTXSID60149065

Created by admin on Mon Mar 31 21:51:16 GMT 2025 , Edited by admin on Mon Mar 31 21:51:16 GMT 2025

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