Structure #1
  Mrv0541 02231216222D          

 26 25  0  0  0  0            999 V2000
   -3.9039    2.0329    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1895    0.7954    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.2408    2.0329    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    2.5263    0.7954    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7605    0.7954    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4750    3.6829    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6500    2.8579    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3000    2.8579    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6368    2.8579    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9868    2.8579    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8118    3.6829    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7441    0.9059    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0809    2.3349    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5099    0.9059    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6849    2.3349    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0461    2.0329    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3829    1.2079    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4750    2.0329    0.0000 O   0  3  0  0  0  0  0  0  0  0  0  0
    1.8118    2.0329    0.0000 O   0  3  0  0  0  0  0  0  0  0  0  0
   -3.1895    1.6204    0.0000 V   0  0  0  0  0  0  0  0  0  0  0  0
    2.5263    1.6204    0.0000 V   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7605    1.6204    0.0000 V   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4750    2.8579    0.0000 V   0  0  0  0  0  0  0  0  0  0  0  0
    1.8118    2.8579    0.0000 V   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3316    1.6204    0.0000 V   0  0  0  0  0  0  0  0  0  0  0  0
    1.0974    1.6204    0.0000 V   0  0  0  0  0  0  0  0  0  0  0  0
  1 20  2  0  0  0  0
  2 20  1  0  0  0  0
  3 21  1  0  0  0  0
  4 21  2  0  0  0  0
  5 22  2  0  0  0  0
  6 23  2  0  0  0  0
  7 23  2  0  0  0  0
  8 23  2  0  0  0  0
  9 24  2  0  0  0  0
 10 24  2  0  0  0  0
 11 24  2  0  0  0  0
 12 25  2  0  0  0  0
 13 25  2  0  0  0  0
 14 26  2  0  0  0  0
 15 26  2  0  0  0  0
 16 22  1  0  0  0  0
 16 25  1  0  0  0  0
 17 25  1  0  0  0  0
 17 26  1  0  0  0  0
 18 20  1  0  0  0  0
 18 22  1  0  0  0  0
 18 23  1  0  0  0  0
 19 21  1  0  0  0  0
 19 24  1  0  0  0  0
 19 26  1  0  0  0  0
M  CHG  4   2  -1   3  -1  18   1  19   1
M  END
> <DATABASE_ID>
DB02681

> <DATABASE_NAME>
drugbank

> <SMILES>
[O-][V](=O)[O+]([V](=O)O[V](=O)(=O)O[V](=O)(=O)[O+]([V]([O-])=O)[V](=O)(=O)=O)[V](=O)(=O)=O

> <INCHI_IDENTIFIER>
InChI=1S/19O.7V/q;;;;;;;;;;;;;;;2*-1;2*+1;;;;;;;

> <INCHI_KEY>
InChIKey=ONZDNYIINYVFKD-UHFFFAOYSA-N

> <JCHEM_ACCEPTOR_COUNT>
15

> <JCHEM_AVERAGE_POLARIZABILITY>
33.906803665837145

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_EXACT_MASS>
660.511123543

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_FORMULA>
O19V7

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
2,8-bis[oxido(oxo)vanadio]-1,1,1,3,5,5,7,7,9,9,9-undecaoxopentavanadoxane-2,8-diium

> <JCHEM_LOGP>
-5.498200000000001

> <JCHEM_MASS>
660.5791

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
2

> <JCHEM_PKA>
11.045761612141337

> <JCHEM_PKA_STRONGEST_ACIDIC>
10.44196115171402

> <JCHEM_PKA_STRONGEST_BASIC>
-7.195672645934918

> <JCHEM_POLAR_SURFACE_AREA>
313.6699999999999

> <JCHEM_REFRACTIVITY>
50.57370000000001

> <JCHEM_ROTATABLE_BOND_COUNT>
10

> <JCHEM_RULE_OF_FIVE>
0

> <JCHEM_TRADITIONAL_IUPAC>
2,8-bis[oxido(oxo)vanadio]-1,1,1,3,5,5,7,7,9,9,9-undecaoxopentavanadoxane-2,8-diium

> <JCHEM_VEBER_RULE>
0

> <DRUGBANK_ID>
DB02681

> <DRUG_GROUPS>
experimental

> <GENERIC_NAME>
Meta Vanadate

$$$$