Marvin  12050523122D          

  9  8  0  0  0  0            999 V2000
    1.6500    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8250    0.0000    0.0000 P   0  0  3  0  0  0  0  0  0  0  0  0
    0.8250   -0.8250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8250    0.8250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8250    0.0000    0.0000 P   0  0  3  0  0  0  0  0  0  0  0  0
   -0.8250   -0.8250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8250    0.8250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6500    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  2  0  0  0  0
  2  9  1  0  0  0  0
  9  5  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  2  0  0  0  0
  5  8  1  0  0  0  0
M  END
> <ID>
CHEBI:29888

> <NAME>
diphosphoric acid

> <DEFINITION>
An acyclic phosphorus acid anhydride obtained by condensation of two molecules of phosphoric acid.

> <STAR>
3

> <SECONDARY_ID>
CHEBI:45067; CHEBI:8683

> <SYNONYM>
Pyrophosphorsaeure; Pyrophosphoric acid; Pyrophosphate; PYROPHOSPHATE; H4P2O7; Diphosphorsaeure; Diphosphoric acid; acide diphosphorique; [(HO)2P(O)OP(O)(OH)2]

> <IUPAC_NAME>
mu-oxido-bis(dihydroxidooxidophosphorus); diphosphoric acid; 1,5-dihydrido-2,4-dihydroxido-2,4-dioxido-1,3,5-trioxy-2,4-diphosphy-[5]catena

> <FORMULA>
H4O7P2

> <MASS>
177.97508

> <MONOISOTOPIC_MASS>
177.94323

> <CHARGE>
0

> <SMILES>
OP(O)(=O)OP(O)(O)=O

> <INCHI>
InChI=1S/H4O7P2/c1-8(2,3)7-9(4,5)6/h(H2,1,2,3)(H2,4,5,6)

> <INCHIKEY>
XPPKVPWEQAFLFU-UHFFFAOYSA-N

> <CAS_REGISTRY_NUMBER>
2466-09-3

> <GMELIN_REGISTRY_NUMBER>
82619

> <REAXYS_REGISTRY_NUMBER>
3942075

> <CHEMIDPLUS>
2466-09-3

> <DRUGBANK_ACCESSION>
DB04160

> <ECMDB_ACCESSION>
ECMDB04142

> <KEGG_COMPOUND_ACCESSION>
C00013

> <KNAPSACK_ACCESSION>
C00019561

> <NIST_CHEMISTRY_WEBBOOK>
2466-09-3

> <PDBECHEM_ACCESSION>
PPV

> <PUBMED_CITATION>
6291941

$$$$