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CHEBI:85936 - 5-amino-5-(4-hydroxybenzyl)-6-(D-ribitylimino)-5,6-dihydrouracil

ChEBI IDCHEBI:85936
ChEBI Name5-amino-5-(4-hydroxybenzyl)-6-(D-ribitylimino)-5,6-dihydrouracil
Stars
ASCII Name5-amino-5-(4-hydroxybenzyl)-6-(D-ribitylimino)-5,6-dihydrouracil
DefinitionA member of the class of pyrimidones that is 5,6-diamino-5-[(4-hydroxyphenyl)methyl]pyrimidine-2,4-dione in which the imino hydrogen at position 6 is replaced by a D-ribityl group.
Secondary ChEBI IDCHEBI:138638
Last Modified15 December 2017
SubmitterKristian Axelsen, Steve
DownloadsMolfile
FormulaC16H22N4O7
Net Charge0
Average Mass382.373
Monoisotopic Mass382.14885
SMILESNC1(Cc2ccc(O)cc2)C(=O)NC(=O)N/C1=N/C[C@H](O)[C@H](O)[C@H](O)CO
InChIInChI=1S/C16H22N4O7/c17-16(5-8-1-3-9(22)4-2-8)13(19-15(27)20-14(16)26)18-6-10(23)12(25)11(24)7-21/h1-4,10-12,21-25H,5-7,17H2,(H2,18,19,20,26,27)/t10-,11+,12-,16?/m0/s1
InChIKeyXETIGMNRSOUDLK-USDBNLMRSA-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-amino-5-(4-hydroxybenzyl)-6-(D-ribitylimino)-5,6-dihydrouracil (CHEBI:85936) has functional parent ribitol (CHEBI:15963)
5-amino-5-(4-hydroxybenzyl)-6-(D-ribitylimino)-5,6-dihydrouracil (CHEBI:85936) is a phenols (CHEBI:33853)
5-amino-5-(4-hydroxybenzyl)-6-(D-ribitylimino)-5,6-dihydrouracil (CHEBI:85936) is a primary amino compound (CHEBI:50994)
5-amino-5-(4-hydroxybenzyl)-6-(D-ribitylimino)-5,6-dihydrouracil (CHEBI:85936) is a pyrimidone (CHEBI:38337)
5-amino-5-(4-hydroxybenzyl)-6-(D-ribitylimino)-5,6-dihydrouracil (CHEBI:85936) is conjugate base of 5-amino-5-(4-hydroxybenzyl)-6-(D-ribitylimino)-5,6-dihydrouracil(1+) (CHEBI:85512)
Incoming Relation(s)
5-amino-5-(4-hydroxybenzyl)-6-(D-ribitylimino)-5,6-dihydrouracil(1+) (CHEBI:85512) is conjugate acid of 5-amino-5-(4-hydroxybenzyl)-6-(D-ribitylimino)-5,6-dihydrouracil (CHEBI:85936)
IUPAC Name 
1-({5-amino-5-[(4-hydroxyphenyl)methyl]-2,6-dioxo-1,2,5,6-tetrahydropyrimidin-4-yl}amino)-1-deoxy-D-ribitol
Synonym  Source
5-amino-5-(4-hydroxybenzyl)-6-((2,3,4,5-tetrahydroxypentyl)amino)dihydropyrimidine-2,4-dioneChEBI
UniProt Name  Source
5-amino-5-(4-hydroxybenzyl)-6-(D-ribitylimino)-5,6-dihydrouracilUniProt
Citations