Chemical Compound

Apppgpp

CAS Registry Number 56878-12-7
Apppgpp chemical structure
Primary Record

Apppgpp

In stock
1,984 g
Purity
98.4 %
CAS
56878-12-7

Compound Identifiers & Properties

CAS
56878-12-7
PubChem CID
135600309
SMILES
C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C5N=C(NC6=O)N)O)OP(=O)(O)OP(=O)(O)O)O)O)N
Canonical SMILES
Nc1nc2c(ncn2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](OP(=O)(O)OP(=O)(O)O)[C@H]2O)c(=O)[nH]1

Names & Synonyms

  • Apppgpp
  • AC1MIVTX
  • RefChem:109706
  • C20H29N10O23P5
  • CID3080843
  • Adenosine 5',5'''-triphosphoguanosine-3'''-diphosphate
  • C20-H29-N10-O23-P5
  • 56878-12-7
  • [(2R,3S,4R,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-2-[[[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxymethyl]-4-hydroxyoxolan-3-yl] phosphono hydrogen phosphate
  • Guanosine 5'-(tetrahydrogen triphosphate), 3'-(trihydrogen diphosphate), 5'-5'-ester with adenosine