Marvin  07081013452D          

 29 30  0  0  1  0            999 V2000
   13.9736   -4.6394    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   13.9736   -3.8144    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.3061   -5.1243    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.6411   -5.1243    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   14.6880   -3.4019    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2591   -3.4019    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5611   -5.9089    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   14.3861   -5.9089    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   15.4256   -4.8693    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.6880   -2.5769    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.4026   -3.8144    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.2591   -2.5769    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8710   -6.5763    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.9736   -2.1644    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9925   -6.3628    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    9.4214   -6.3628    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.8504   -6.3628    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.7069   -7.6003    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.7069   -5.9503    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1358   -7.6003    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1358   -5.9503    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   11.5648   -7.6003    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5648   -5.9503    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    8.7069   -6.7753    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   10.1358   -6.7753    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   11.5648   -6.7753    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   12.2793   -6.3628    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.0762   -6.5763    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9736   -1.3394    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  1  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  4  9  1  6  0  0  0
  5 10  1  0  0  0  0
  5 11  2  0  0  0  0
  6 12  2  0  0  0  0
  7 28  1  1  0  0  0
  8 13  1  6  0  0  0
 10 14  1  0  0  0  0
 14 29  2  0  0  0  0
  7  8  1  0  0  0  0
 12 14  1  0  0  0  0
 15 24  1  0  0  0  0
 24 16  1  0  0  0  0
 16 25  1  0  0  0  0
 25 17  1  0  0  0  0
 17 26  1  0  0  0  0
 26 27  1  0  0  0  0
 24 18  2  0  0  0  0
 24 19  1  0  0  0  0
 25 20  2  0  0  0  0
 25 21  1  0  0  0  0
 26 22  2  0  0  0  0
 26 23  1  0  0  0  0
 28 27  1  0  0  0  0
M  CHG  3  15  -1  21  -1  23  -1
M  END
> <ID>
CHEBI:57481

> <NAME>
UTP(3-)

> <DEFINITION>
Trianion of UTP arising from deprotonation of three of the OH groups from the triphosphate moiety.

> <STAR>
3

> <SYNONYM>
UTP trianion; UTP (3-)

> <FORMULA>
C9H12N2O15P3

> <MASS>
481.11730

> <MONOISOTOPIC_MASS>
480.94670

> <CHARGE>
-3

> <SMILES>
O[C@@H]1[C@@H](COP([O-])(=O)OP([O-])(=O)OP(O)([O-])=O)O[C@H]([C@@H]1O)n1ccc(=O)[nH]c1=O

> <INCHI>
InChI=1S/C9H15N2O15P3/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H,10,12,15)(H2,16,17,18)/p-3/t4-,6-,7-,8-/m1/s1

> <INCHIKEY>
PGAVKCOVUIYSFO-XVFCMESISA-K

> <BEILSTEIN_REGISTRY_NUMBER>
3807363

$$$$