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CHEBI:131616 - 5-(β-D-glucosylmethyl)cytosine

ChEBI IDCHEBI:131616
ChEBI Name5-(β-D-glucosylmethyl)cytosine
Stars
ASCII Name5-(beta-D-glucosylmethyl)cytosine
DefinitionA β-D-glucoside derived from formal condensation of the hydroxy group of 5-(hydroxymethyl)cytosine with the anomeric hydroxy group of D-glucopyranose.
Last Modified30 March 2016
SubmitterGareth Owen
DownloadsMolfile
FormulaC11H17N3O7
Net Charge0
Average Mass303.271
Monoisotopic Mass303.10665
SMILESNc1nc(=O)ncc1CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C11H17N3O7/c12-9-4(1-13-11(19)14-9)3-20-10-8(18)7(17)6(16)5(2-15)21-10/h1,5-8,10,15-18H,2-3H2,(H3,12,13,14,19)/t5-,6-,7+,8-,10-/m1/s1
InChIKeySBHSUMUTJOPRIK-HPFNVAMJSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
5-(β-D-glucosylmethyl)cytosine (CHEBI:131616) has functional parent 5-(hydroxymethyl)cytosine (CHEBI:76792)
5-(β-D-glucosylmethyl)cytosine (CHEBI:131616) is a aminopyrimidine (CHEBI:38338)
5-(β-D-glucosylmethyl)cytosine (CHEBI:131616) is a pyrimidone (CHEBI:38337)
5-(β-D-glucosylmethyl)cytosine (CHEBI:131616) is a β-D-glucoside (CHEBI:22798)
IUPAC Name 
(4-amino-2-oxo-1,2-dihydropyrimidin-5-yl)methyl β-D-glucopyranoside
Synonyms  Source
5-gmCChEBI
5-glucosylmethylcytosineChEBI
5-β-D-glucosylmethylcytosineChEBI
β-D-glucosyl-5-hydroxymethylcytosineChEBI
β-glucosyl-5-hydroxymethylcytosineChEBI
Citations