CHEBI:85512 - 5-amino-5-(4-hydroxybenzyl)-6-(D-ribitylimino)-5,6-dihydrouracil(1+)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 5-amino-5-(4-hydroxybenzyl)-6-(D-ribitylimino)-5,6-dihydrouracil(1+)
ChEBI ID CHEBI:85512
ChEBI ASCII Name 5-amino-5-(4-hydroxybenzyl)-6-(D-ribitylimino)-5,6-dihydrouracil(1+)
Definition An organic cation obtained by protonation of the 5-amino group of 5-amino-5-(4-hydroxybenzyl)-6-((2,3,4,5-tetrahydroxypentyl)amino)dihydropyrimidine-2,4-dione.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Gemma Holliday
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C16H23N4O7
Net Charge +1
Average Mass 383.37590
Monoisotopic Mass 383.15613
InChI InChI=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)/p+1/t10-,11+,12-,16?/m0/s1
InChIKey XETIGMNRSOUDLK-USDBNLMRSA-O
SMILES [NH3+]C1(Cc2ccc(O)cc2)C(=O)NC(=O)N\C1=N\C[C@H](O)[C@H](O)[C@H](O)CO
ChEBI Ontology
Outgoing 5-amino-5-(4-hydroxybenzyl)-6-(D-ribitylimino)-5,6-dihydrouracil(1+) (CHEBI:85512) is a ammonium ion derivative (CHEBI:35274)
5-amino-5-(4-hydroxybenzyl)-6-(D-ribitylimino)-5,6-dihydrouracil(1+) (CHEBI:85512) is a organic cation (CHEBI:25697)
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)
Incoming 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)
IUPAC Name
1-({5-azaniumyl-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-dione(1+) ChEBI
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Last Modified
14 December 2017