CHEBI:136518 - 8-amino-8-demethylriboflavin(1−)

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ChEBI Name 8-amino-8-demethylriboflavin(1−)
ChEBI ID CHEBI:136518
ChEBI ASCII Name 8-amino-8-demethylriboflavin(1-)
Definition An organic anion that is the conjugate base of 8-amino-8-demethylriboflavin, obtained by removal of the imide proton at position 3. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
Supplier Information
Download Molfile XML SDF
Formula C16H18N5O6
Net Charge -1
Average Mass 376.345
Monoisotopic Mass 376.12626
InChI InChI=1S/C16H19N5O6/c1-6-2-8-9(3-7(6)17)21(4-10(23)13(25)11(24)5-22)14-12(18-8)15(26)20-16(27)19-14/h2-3,10-11,13,22-25H,4-5H2,1H3,(H3,17,19,20,26,27)/p-1/t10-,11+,13-/m0/s1
InChIKey QKWPIZQKTLHNOD-LOWVWBTDSA-M
SMILES C(N1C=2C(=NC3=C1C=C(C(=C3)C)N)C([N-]C(N2)=O)=O)[C@H](O)[C@H](O)[C@H](O)CO
ChEBI Ontology
Outgoing 8-amino-8-demethylriboflavin(1−) (CHEBI:136518) is a organic anion (CHEBI:25696)
8-amino-8-demethylriboflavin(1−) (CHEBI:136518) is conjugate base of 8-amino-8-demethylriboflavin (CHEBI:137336)
Incoming 8-amino-8-demethylriboflavin 5'-phosphate(3−) (CHEBI:139569) has functional parent 8-amino-8-demethylriboflavin(1−) (CHEBI:136518)
8-amino-8-demethylriboflavin (CHEBI:137336) is conjugate acid of 8-amino-8-demethylriboflavin(1−) (CHEBI:136518)
IUPAC Name
1-(8-amino-7-methyl-2,4-dioxo-2H-benzo[g]pteridin-3-id-10(4H)-yl)-1-deoxy-D-ribitol
Synonym Source
8-amino-8-demethylriboflavin UniProt
Manual Xref Database
CPD-19835 MetaCyc
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Citations Waiting for Citations Types Sources
21911488 PubMed citation SUBMITTER
26913589 PubMed citation SUBMITTER
Last Modified
06 June 2017