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CHEBI:149752 - 8-(1,2-dideoxy-1-D-ribityl)-7-methyllumazine

ChEBI IDCHEBI:149752
ChEBI Name8-(1,2-dideoxy-1-D-ribityl)-7-methyllumazine
Stars
ASCII Name8-(1,2-dideoxy-1-D-ribityl)-7-methyllumazine
DefinitionA pteridine that is lumazine substituted with a 1,2-dideoxy-1-D-ribityl group at position 8 and a methyl group at position 7; one of 20 modifications to the potent microbial riboflavin-based metabolite antigen 5-(2-oxopropylideneamino)-6-D-ribityl aminouracil (5-OP-RU), an activator of mucosal-associated invariant T (MAIT) cells when presented by the MR1 protein (reported in MED:32123373).
Last Modified14 May 2020
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC13H18N4O4
Net Charge0
Average Mass294.311
Monoisotopic Mass294.13281
SMILESCC[C@@H](O)[C@@H](O)CCn1c(C)cnc2c(=O)nc(=O)nc1-2
InChIInChI=1S/C13H18N4O4/c1-3-8(18)9(19)4-5-17-7(2)6-14-10-11(17)15-13(21)16-12(10)20/h6,8-9,18-19H,3-5H2,1-2H3,(H,16,20,21)/t8-,9+/m1/s1
InChIKeyWKRJQROSCMIDIN-BDAKNGLRSA-N
ChEBI Ontology
Outgoing Relation(s)
8-(1,2-dideoxy-1-D-ribityl)-7-methyllumazine (CHEBI:149752) has functional parent lumazine (CHEBI:16489)
8-(1,2-dideoxy-1-D-ribityl)-7-methyllumazine (CHEBI:149752) has functional parent ribitol (CHEBI:15963)
8-(1,2-dideoxy-1-D-ribityl)-7-methyllumazine (CHEBI:149752) is a pteridines (CHEBI:26373)
IUPAC Name 
8-[(3S,4R)-3,4-dihydroxyhexyl]-7-methylpteridine-2,4(3H,8H)-dione
Synonyms  Source
2'-D-RL-7-MeIUPAC
8-[(3S,4R)-3,4-dihydroxyhexyl]-7-methyl-2,4(3H,8H)-pteridinedioneIUPAC
Citations