CHEBI:77675 - epoxyqueuine(1+)

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ChEBI Name epoxyqueuine(1+)
ChEBI ID CHEBI:77675
Definition An organic cation that is the conjugate acid of epoxyqueuine, obtained by protonation of the secondary amino group; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Anne Morgat
Supplier Information
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Formula C12H16N5O4
Net Charge +1
Average Mass 294.28600
Monoisotopic Mass 294.11968
InChI InChI=1S/C12H15N5O4/c13-12-16-10-4(11(20)17-12)3(2-15-10)1-14-5-6(18)7(19)9-8(5)21-9/h2,5-9,14,18-19H,1H2,(H4,13,15,16,17,20)/p+1/t5-,6-,7-,8-,9+/m1/s1
InChIKey JSGKREWPBLKPCZ-OKNNCHMLSA-O
SMILES Nc1nc2[nH]cc(C[NH2+][C@H]3[C@H]4O[C@H]4[C@H](O)[C@@H]3O)c2c(=O)[nH]1
ChEBI Ontology
Outgoing epoxyqueuine(1+) (CHEBI:77675) is a ammonium ion derivative (CHEBI:35274)
epoxyqueuine(1+) (CHEBI:77675) is a organic cation (CHEBI:25697)
epoxyqueuine(1+) (CHEBI:77675) is conjugate acid of epoxyqueuine (CHEBI:64129)
Incoming epoxyqueuine (CHEBI:64129) is conjugate base of epoxyqueuine(1+) (CHEBI:77675)
IUPAC Name
(1R,2R,3R,4R,5S)-N-[(2-amino-4-oxo-4,7-dihydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl)methyl]-3,4-dihydroxy-6-oxabicyclo[3.1.0]hexan-2-aminium
Synonym Source
epoxyqueuine UniProt
Last Modified
17 April 2014