2'-deoxyinosine-5'-monophosphate (CHEBI:28806)

CHEBI:28806 - 2'-deoxyinosine-5'-monophosphate

ChEBI ID	CHEBI:28806
ChEBI Name	2'-deoxyinosine-5'-monophosphate
Stars
Definition	A deoxyinosine phosphate that is 5'-inosinic acid in which the hydroxy group at position 2' by a hydrogen atom.
Secondary ChEBI IDs	CHEBI:837, CHEBI:19250, CHEBI:41998, CHEBI:43315, CHEBI:43377, CHEBI:43384, CHEBI:43389, CHEBI:44500
Last Modified	14 June 2016
Downloads	Molfile

Formula	C10H13N4O7P
Net Charge	0
Average Mass	332.209
Monoisotopic Mass	332.05219
SMILES	O=c1ncnc2c1ncn2[C@H]1C[C@H](O)[C@@H](COP(=O)(O)O)O1
InChI	InChI=1S/C10H13N4O7P/c15-5-1-7(21-6(5)2-20-22(17,18)19)14-4-13-8-9(14)11-3-12-10(8)16/h3-7,15H,1-2H2,(H,11,12,16)(H2,17,18,19)/t5-,6+,7+/m0/s1
InChIKey	PHNGFPPXDJJADG-RRKCRQDMSA-N

Wikipedia

Species of Metabolite	Component	Source	Comments
Escherichia coli (ncbitaxon:562)	-	PubMed (21988831)
Mus musculus (ncbitaxon:10090)	-	PubMed (19425150)	Source: BioModels - MODEL1507180067
Mycoplasma genitalium (ncbitaxon:2097)	-	PubMed (22817898)

Roles Classification

Escherichia coli metabolite Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.

mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).

Mycoplasma genitalium metabolite Any bacterial metabolite produced during a metabolic reaction in Mycoplasma genitalium.

human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).

ChEBI Ontology

Outgoing Relation(s)
	2'-deoxyinosine-5'-monophosphate (CHEBI:28806) has functional parent IMP (CHEBI:17202)
	2'-deoxyinosine-5'-monophosphate (CHEBI:28806) has role Escherichia coli metabolite (CHEBI:76971)
	2'-deoxyinosine-5'-monophosphate (CHEBI:28806) has role Mycoplasma genitalium metabolite (CHEBI:131604)
	2'-deoxyinosine-5'-monophosphate (CHEBI:28806) has role human metabolite (CHEBI:77746)
	2'-deoxyinosine-5'-monophosphate (CHEBI:28806) has role mouse metabolite (CHEBI:75771)
	2'-deoxyinosine-5'-monophosphate (CHEBI:28806) is a deoxyinosine phosphate (CHEBI:23630)
	2'-deoxyinosine-5'-monophosphate (CHEBI:28806) is a purine 2'-deoxyribonucleoside 5'-monophosphate (CHEBI:36993)
	2'-deoxyinosine-5'-monophosphate (CHEBI:28806) is conjugate acid of 2'-deoxyinosine 5'-phosphate(2−) (CHEBI:61194)
Incoming Relation(s)
Incoming Relation(s)	2'-deoxyinosine 5'-phosphate(2−) (CHEBI:61194) is conjugate base of 2'-deoxyinosine-5'-monophosphate (CHEBI:28806)

IUPAC Names
2'-deoxy-5'-inosinic acid
[(2R,3S,4R,5R)-3-hydroxy-5-(6-hydroxy-9H-purin-9-yl)tetrahydrofuran-2-yl]methyl dihydrogen phosphate

Synonyms	Source
2'-deoxy-5'-inosinic acid	PDBeChem
2'-Deoxyinosine 5'-monophosphate	ChemIDplus
2'-Deoxyinosine 5'-monophosphoric acid	HMDB
2'-Deoxyinosine 5'-phosphate	KEGG COMPOUND
2'-Deoxyinosine 5'-phosphate	HMDB
9-(2-deoxy-5-O-phosphono-β-D-erythro-pentofuranosyl)-9H-purin-6-ol	IUPAC

Manual Xrefs	Databases
C06196	KEGG COMPOUND
Deoxyinosine_monophosphate	Wikipedia
DI	PDBeChem
DIMP	MetaCyc
HMDB0006555	HMDB

Registry Numbers	Sources
Reaxys:583139	Reaxys
CAS:3393-18-8	ChemIDplus

Citations