5-bromo-2'-deoxyuridine (CHEBI:472552)

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ChEBI Name	5-bromo-2'-deoxyuridine

ChEBI ID	CHEBI:472552

Definition	A pyrimidine 2'-deoxyribonucleoside compound having 5-bromouracil as the nucleobase.

Stars	This entity has been manually annotated by the ChEBI Team.

Secondary ChEBI IDs	CHEBI:47713, CHEBI:31310

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Formula

C9H11BrN2O5

Net Charge

Average Mass

307.09800

Monoisotopic Mass

305.98513

InChI

InChI=1S/C9H11BrN2O5/c10-4-2-12(9(16)11-8(4)15)7-1-5(14)6(3-13)17-7/h2,5-7,13-14H,1,3H2,(H,11,15,16)/t5-,6+,7+/m0/s1

InChIKey

WOVKYSAHUYNSMH-RRKCRQDMSA-N

SMILES

OC[C@H]1O[C@H](C[C@@H]1O)n1cc(Br)c(=O)[nH]c1=O

Roles Classification
Biological Role(s):	antimetabolite A substance which is structurally similar to a metabolite but which competes with it or replaces it, and so prevents or reduces its normal utilization.

Application(s):	antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms.

ChEBI Ontology
Outgoing	5-bromo-2'-deoxyuridine (CHEBI:472552) has role antimetabolite (CHEBI:35221) 5-bromo-2'-deoxyuridine (CHEBI:472552) has role antineoplastic agent (CHEBI:35610) 5-bromo-2'-deoxyuridine (CHEBI:472552) is a pyrimidine 2'-deoxyribonucleoside (CHEBI:19255)

IUPAC Name

5-bromo-2'-deoxyuridine

Last Modified

06 March 2017