CHEBI:28400 - P1,P4-bis(5'-xanthosyl) tetraphosphate

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ChEBI Name P1,P4-bis(5'-xanthosyl) tetraphosphate
ChEBI ID CHEBI:28400
ChEBI ASCII Name P(1),P(4)-bis(5'-xanthosyl) tetraphosphate
Definition A purine ribonucleoside 5'-tetraphosphate compound having 5'-xanthosyl residues at the P1- and P4-positions.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:7878, CHEBI:22001
Supplier Information
Download Molfile XML SDF
Formula C20H26N8O23P4
Net Charge 0
Average Mass 870.35530
Monoisotopic Mass 870.00613
InChI InChI=1S/C20H26N8O23P4/c29-9-5(47-17(11(9)31)27-3-21-7-13(27)23-19(35)25-15(7)33)1-45-52(37,38)49-54(41,42)51-55(43,44)50-53(39,40)46-2-6-10(30)12(32)18(48-6)28-4-22-8-14(28)24-20(36)26-16(8)34/h3-6,9-12,17-18,29-32H,1-2H2,(H,37,38)(H,39,40)(H,41,42)(H,43,44)(H2,23,25,33,35)(H2,24,26,34,36)/t5-,6-,9-,10-,11-,12-,17-,18-/m1/s1
InChIKey PNTZPNDMKHCLNV-MHARETSRSA-N
SMILES O[C@@H]1[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c2[nH]c(=O)[nH]c3=O)O[C@H]([C@@H]1O)n1cnc2c1[nH]c(=O)[nH]c2=O
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Source: BioModels - MODEL1507180067 See: PubMed
Roles Classification
Biological Role(s): mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing P1,P4-bis(5'-xanthosyl) tetraphosphate (CHEBI:28400) has role mouse metabolite (CHEBI:75771)
P1,P4-bis(5'-xanthosyl) tetraphosphate (CHEBI:28400) is a purine ribonucleoside 5'-tetraphosphate (CHEBI:37067)
P1,P4-bis(5'-xanthosyl) tetraphosphate (CHEBI:28400) is a xanthosine 5'-phosphate (CHEBI:53012)
IUPAC Name
xanthosine(5')tetraphospho(5')xanthosine
Synonyms Sources
P1,P4-Bis(5'-xanthosyl) tetraphosphate KEGG COMPOUND
XppppX KEGG COMPOUND
Manual Xref Database
C04392 KEGG COMPOUND
View more database links
Last Modified
27 January 2016