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CHEBI:199822 - Biopterin-a-glucoside

ChEBI IDCHEBI:199822
ChEBI NameBiopterin-a-glucoside
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H21N5O8
Net Charge0
Average Mass399.360
Monoisotopic Mass399.13901
SMILESC[C@@H](OC1OC(CO)C(O)C(O)C1O)[C@H](O)c1cnc2nc(N)nc(=O)c2n1
InChIInChI=1S/C15H21N5O8/c1-4(27-14-11(25)10(24)9(23)6(3-21)28-14)8(22)5-2-17-12-7(18-5)13(26)20-15(16)19-12/h2,4,6,8-11,14,21-25H,3H2,1H3,(H3,16,17,19,20,26)/t4-,6?,8+,9?,10?,11?,14?/m1/s1
InChIKeyUBSQWCUHJNTZFU-STDHHERASA-N
Species of MetaboliteComponentSourceComments
Spirulina (ncbitaxon:1154) - DOI (10.1007/pl00011769)
ChEBI Ontology
Outgoing Relation(s)
Biopterin-a-glucoside (CHEBI:199822) is a biopterins (CHEBI:22881)
IUPAC Name 
2-amino-6-[(1R,2R)-1-hydroxy-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropyl]-3H-pteridin-4-one
Manual XrefsDatabases
78445049ChemSpider