P1,P4-bis(5'-adenosyl) tetraphosphate

P<sup>1</sup>,P<sup>4</sup>-<i>bis</i>(5'-adenosyl) tetraphosphate




Chemical Formula:
C20H24N10O19P4
Molecular Weight:
832.36 Daltons
Monoisotopic Mass:
836.0482648107001 Daltons
SMILES:
C(C1(C(C(C(O1)N3(C=NC2(C(=NC=NC=23)N)))O)O))OP(OP(OP(OP(OCC4(C(C(C(O4)N6(C=NC5(C(=NC=NC=56)N)))O)O))([O-])=O)([O-])=O)([O-])=O)([O-])=O
InChI:
1S/C20H28N10O19P4/c21-15-9-17(25-3-23-15)29(5-27-9)19-13(33)11(31)7(45-19)1-43-50(35,36)47-52(39,40)49-53(41,42)48-51(37,38)44-2-8-12(32)14(34)20(46-8)30-6-28-10-16(22)24-4-26-18(10)30/h3-8,11-14,19-20,31-34H,1-2H2,(H,35,36)(H,37,38)(H,39,40)(H,41,42)(H2,21,23,25)(H2,22,24,26)/p-4/t7-,8-,11-,12-,13-,14-,19-,20-/m1/s1
InChIKey:
YOAHKNVSNCMZGQ-XPWFQUROSA-J

Synonyms
  • Ap4A
  • AppppA
  • P(1),P(4)-bis(5'-adenosyl)tetraphosphate
  • bis(5'-adenosyl) tetraphosphate
  • 5',5'''-diadenosine tetraphosphate

Databases
MetaCyc:  ADENOSYL-P4
BiGG:  ap4a
MetaboLights:  MTBLC58141
HMDB:  HMDB01211
ChEBI:  58141
PubChem (CID):  25243905
KEGG:  C01260
Seed:  cpd00924
MetaNetX:  MNXM1089