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CHEBI:193936 - Guanosine triphosphate adenosine

ChEBI IDCHEBI:193936
ChEBI NameGuanosine triphosphate adenosine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H27N10O17P3
Net Charge0
Average Mass772.411
Monoisotopic Mass772.07685
SMILESNc1nc(=O)c2ncn([C@@H]3O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)OC[C@H]4O[C@@H](n5cnc6c(N)ncnc65)C(O)C4O)C(O)C3O)c2n1
InChIInChI=1S/C20H27N10O17P3/c21-14-8-15(24-3-23-14)29(4-25-8)18-12(33)10(31)6(44-18)1-42-48(36,37)46-50(40,41)47-49(38,39)43-2-7-11(32)13(34)19(45-7)30-5-26-9-16(30)27-20(22)28-17(9)35/h3-7,10-13,18-19,31-34H,1-2H2,(H,36,37)(H,38,39)(H,40,41)(H2,21,23,24)(H3,22,27,28,35)/t6-,7-,10?,11?,12?,13?,18-,19-/m1/s1
InChIKeyPMJUJCUPNRCBNP-KNKPYYCGSA-N
Species of MetaboliteComponentSourceComments
synthetic microbial community (ncbitaxon:3229850) Whole Organism (NCIT:C13413) MetaboLights (MTBLS3129)
ChEBI Ontology
Outgoing Relation(s)
Guanosine triphosphate adenosine (CHEBI:193936) is a dinucleotide (CHEBI:47885)
IUPAC Name 
[[(2R,5R)-5-(2-amino-6-oxo-1H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [[(2R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] hydrogen phosphate
Manual XrefsDatabases
HMDB0001459HMDB
35013035ChemSpider