FComEx: 2'-Deoxyinosine (PC000330)

Record Information

Version

1.0

Creation date

2015-10-09 22:29:58 UTC

Update date

2017-01-19 02:36:20 UTC

FoodComEx ID

PC000330

FoodDB Record

FDB012323

Chemical Information

Name

2'-Deoxyinosine

Description

Isolated from Phaseolus vulgaris (kidney bean). 2'-Deoxyinosine is found in pulses, yellow wax bean, and green bean.

CAS Number

890-38-0

Structure

MOL SDF PDB SMILES InChI

Synonyms

Synonym	Source
2-Deoxy-inosine	HMDB
9-(2-Deoxy-b-D-erythro-pentofuranosyl)-1,9-dihydro-6H-purin-6-one	HMDB
9-(2-Deoxy-b-D-erythro-pentofuranosyl)-9H-purin-6-ol	Generator
9-(2-Deoxy-b-D-erythro-pentofuranosyl)-hypoxanthine	HMDB
9-(2-deoxy-beta-D-erythro-pentofuranosyl)-9H-purin-6-ol	manual
9-(2-Deoxy-beta-D-erythro-pentofuranosyl)-hypoxanthine	HMDB
9-(2-Deoxy-beta-delta-erythro-pentofuranosyl)-1,9-dihydro-6H-purin-6-one	HMDB
9-(2-Deoxy-beta-delta-erythro-pentofuranosyl)-hypoxanthine	HMDB
9-(2-Deoxy-β-D-erythro-pentofuranosyl)-9H-purin-6-ol	Generator
9-(2-Deoxyribofuranosyl)hypoxanthine	db_source
D-Ino	HMDB
delta-Ino	HMDB
Deoxyinosine	biospider
Hypoxanthine 2-deoxyriboside	db_source

Chemical Formula

C10H12N4O4

IUPAC name

9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-9H-purin-6-ol

InChI Identifier

InChI=1S/C10H12N4O4/c15-2-6-5(16)1-7(18-6)14-4-13-8-9(14)11-3-12-10(8)17/h3-7,15-16H,1-2H2,(H,11,12,17)/t5-,6+,7+/m0/s1

InChI Key

VGONTNSXDCQUGY-RRKCRQDMSA-N

Isomeric SMILES

OC[C@H]1O[C@H](C[C@@H]1O)N1C=NC2=C1N=CNC2=O

Average Molecular Weight

252.23

Monoisotopic Molecular Weight

252.085854882

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as purine 2'-deoxyribonucleosides. Purine 2'-deoxyribonucleosides are compounds consisting of a purine linked to a ribose which lacks a hydroxyl group at position 2.

Kingdom

Organic compounds

Super Class

Nucleosides, nucleotides, and analogues

Class

Purine nucleosides

Sub Class

Purine 2'-deoxyribonucleosides

Direct Parent

Purine 2'-deoxyribonucleosides

Alternative Parents