Marvin  10121210242D          

 17 18  0  0  1  0            999 V2000
    9.6366   -7.6870    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.5340   -5.7499    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8666   -6.2348    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   10.1215   -7.0195    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.0819   -5.9800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4688   -6.5320    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7543   -6.1195    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    7.0399   -6.5320    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7543   -5.2945    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7543   -6.9445    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.2014   -6.2348    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   10.9465   -7.0195    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   11.6139   -7.5043    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.2814   -7.0195    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   12.0264   -6.2348    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.9958   -6.6070    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8647   -7.6027    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  4  1  1  6  0  0  0
  5  6  1  0  0  0  0
  4 12  1  0  0  0  0
  2 11  1  0  0  0  0
  3  4  1  0  0  0  0
  2  3  1  0  0  0  0
  3  5  1  1  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  2  0  0  0  0
  7 10  1  0  0  0  0
 12 13  1  6  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 11 15  1  6  0  0  0
 11 12  1  0  0  0  0
 14 16  2  0  0  0  0
 14 17  1  0  0  0  0
M  END
> <ID>
CHEBI:68689

> <NAME>
5-phospho-alpha-D-ribose cyclic-1,2-phosphate

> <DEFINITION>
A ribose bisphosphate that is the cyclic-1,2-phosphate derivative of 5-phospho-?-D-ribose.

> <STAR>
3

> <SYNONYM>
PRcP; alpha-D-ribose 1,2-cyclic phosphate 5-phosphate; 5-O-phosphono-alpha-D-ribofuranose 1,2-(hydrogen phosphate)

> <FORMULA>
C5H10O10P2

> <MASS>
292.07440

> <MONOISOTOPIC_MASS>
291.97492

> <CHARGE>
0

> <SMILES>
O[C@@H]1[C@@H](COP(O)(O)=O)O[C@@H]2OP(O)(=O)O[C@H]12

> <INCHI>
InChI=1S/C5H10O10P2/c6-3-2(1-12-16(7,8)9)13-5-4(3)14-17(10,11)15-5/h2-6H,1H2,(H,10,11)(H2,7,8,9)/t2-,3-,4-,5-/m1/s1

> <INCHIKEY>
OXGUIUWFXGIWNM-TXICZTDVSA-N

> <REAXYS_REGISTRY_NUMBER>
37426

> <METACYC_ACCESSION>
CPD0-2463

> <PUBMED_CITATION>
22089136

$$$$