8-BROMO-9-.BETA.-D-XYLOFURANOSYLADENINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C10H12BrN5O4
Molecular Weight	346.137
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 8-BROMO-9-.BETA.-D-XYLOFURANOSYLADENINE

Structure Search

SMILES

NC1=NC=NC2=C1N=C(Br)N2[C@@H]3O[C@H](CO)[C@H](O)[C@H]3O

InChI

InChIKey=VJUPMOPLUQHMLE-FTWQFJAYSA-N

InChI=1S/C10H12BrN5O4/c11-10-15-4-7(12)13-2-14-8(4)16(10)9-6(19)5(18)3(1-17)20-9/h2-3,5-6,9,17-19H,1H2,(H2,12,13,14)/t3-,5+,6-,9-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C10H12BrN5O4
Molecular Weight	346.137
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 22:46:00 GMT 2025` Edited by `admin` on `Mon Mar 31 22:46:00 GMT 2025`
Record UNII	32SY6L5LHT
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

8-BROMO-9-.BETA.-D-XYLOFURANOSYLADENINE

Systematic Name

English

9H-PURIN-6-AMINE, 8-BROMO-9-.BETA.-D-XYLOFURANOSYL-

Preferred Name

English

ADENINE, 8-BROMO-9-.BETA.-D-XYLOFURANOSYL-

Systematic Name

English

NQZ-169

Code

English

(2R,3R,4R,5R)-2-(6-AMINO-8-BROMOPURIN-9-YL)-5-(HYDROXYMETHYL)OXOLANE-3,4-DIOL

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID70935890

Created by admin on Mon Mar 31 22:46:00 GMT 2025 , Edited by admin on Mon Mar 31 22:46:00 GMT 2025

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PUBCHEM

10521478

Created by admin on Mon Mar 31 22:46:00 GMT 2025 , Edited by admin on Mon Mar 31 22:46:00 GMT 2025

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CAS

15830-78-1

Created by admin on Mon Mar 31 22:46:00 GMT 2025 , Edited by admin on Mon Mar 31 22:46:00 GMT 2025

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FDA UNII

32SY6L5LHT

Created by admin on Mon Mar 31 22:46:00 GMT 2025 , Edited by admin on Mon Mar 31 22:46:00 GMT 2025

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