Mrv1572004161622022D          

  5  0  0  0  0  0            999 V2000
    0.4125    0.0000    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0
    2.7696    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4125    0.0000    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.7679   -1.6500    0.0000 V   0  0  0  0  0  0  0  0  0  0  0  0
M  CHG  2   1   1   4  -1
M  END
> <DATABASE_ID>
CHEM001406

> <DATABASE_NAME>
chemdb

> <SMILES>
O.O.[OH-].[Na+].[V]

> <INCHI_IDENTIFIER>
InChI=1S/Na.3H2O.V/h;3*1H2;/q+1;;;;/p-1

> <INCHI_KEY>
PJHOCMFWFGVQOF-UHFFFAOYSA-M

> <FORMULA>
H5NaO3V

> <MOLECULAR_WEIGHT>
126.968

> <EXACT_MASS>
126.957595

> <JCHEM_ACCEPTOR_COUNT>
0

> <JCHEM_ATOM_COUNT>
10

> <JCHEM_AVERAGE_POLARIZABILITY>
1.7784

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
sodium dihydrate vanadium hydroxide

> <JCHEM_LOGP>
-0.77

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
1

> <JCHEM_PKA>
3.55

> <JCHEM_PKA_STRONGEST_ACIDIC>
3.09

> <JCHEM_POLAR_SURFACE_AREA>
0.0

> <JCHEM_REFRACTIVITY>
0.0

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
sodium dihydrate vanadium hydroxide

> <JCHEM_VEBER_RULE>
1

> <T3DB_ID>
T3D1646

> <NAME>
Sodium metavanadate

> <CAS>
13718-26-8

> <SYNONYMS>
Monosodium trioxovanadate(1-); NaVO3; Sodium (meta)vanadate; Sodium metavanadate (NaVO3); Sodium metavanadic acid; Sodium trioxovanadate; Sodium trioxovanadate(1-); Sodium vanadate; Sodium vanadate (meta); Sodium vanadate (NaVO3); Sodium vanadate(V) (NaVO3) (6CI,7CI); Sodium vanadite(V), NaVO3; Sodium vanadium oxide; Sodium vanadium oxide (NaVO3); Vanadate (VO31-), sodium; Vanadate(VO3(1-)), sodium; Vanadic acid (hvo3), sodium salt; Vanadic acid (hvo3), sodium salt (8ci); Vanadic acid, monosodium salt

> <TYPES>
Inorganic Compound; Vanadium Compound; Industrial/Workplace Toxin; Natural Compound

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