P1,P3-bis(5'-adenosyl) triphosphate

P<sup>1</sup>,P<sup>3</sup>-<i>bis</i>(5'-adenosyl) triphosphate




Chemical Formula:
C20H24N10O16P3
Molecular Weight:
753.388 Daltons
Monoisotopic Mass:
756.0819344023 Daltons
SMILES:
C(C3(C(C(C(N2(C1(=C(C(=NC=N1)N)N=C2)))O3)O)O))OP(=O)([O-])OP(=O)([O-])OP(=O)([O-])OCC6(C(C(C(N5(C4(=C(C(=NC=N4)N)N=C5)))O6)O)O)
InChI:
1S/C20H27N10O16P3/c21-15-9-17(25-3-23-15)29(5-27-9)19-13(33)11(31)7(43-19)1-41-47(35,36)45-49(39,40)46-48(37,38)42-2-8-12(32)14(34)20(44-8)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)(H2,21,23,25)(H2,22,24,26)/p-3/t7-,8-,11-,12-,13-,14-,19-,20-/m1/s1
InChIKey:
QCICUPZZLIQAPA-XPWFQUROSA-K

Synonyms
  • bis(5'-adenosyl) triphosphate
  • adenosine 5'-(tetrahydrogen triphosphate), P''-5'-ester with adenosine
  • Ap3A
  • adenosine(5')triphospho(5')adenosine
  • 5',5'''-diadenosine triphosphate

Databases
MetaCyc:  ADENOSINE5TRIPHOSPHO5ADENOSINE
HMDB:  HMDB01155
ChEBI:  58529
PubChem (CID):  25201180
KEGG:  C06197
Seed:  cpd03705
MetaNetX:  MNXM3683