58919215
  -OEChem-04192419382D

 80 75  0     1  0  0  0  0  0999 V2000
    5.0981    2.9330    0.0000 Pt  0  0  0  0  0  0  0  0  0  0  0  0
    4.5981    2.0670    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0981    2.9330    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2321    2.4330    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.2321    3.4330    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641    0.5670    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9641    4.4330    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981    3.7990    0.0000 N   0  5  0  0  0  0  0  0  0  0  0  0
    5.5981    2.0670    0.0000 N   0  5  0  0  0  0  0  0  0  0  0  0
    4.0981    2.9330    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.5981    3.7990    0.0000 C   0  5  0  0  0  0  0  0  0  0  0  0
    4.5981    1.0670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9641    3.4330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320    0.5670    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    7.8301    2.9330    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    3.7320   -0.4330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6962    3.4330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660    1.0670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8301    1.9330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -0.9330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5622    2.9330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981   -0.9330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6962    4.4330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -1.9330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4282    3.4330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981   -1.9330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5622    4.9330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320   -2.4330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4282    4.4330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320   -3.4330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2942    4.9330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -3.9330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1603    4.4330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -4.9330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -3.4330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0263    4.9330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1603    3.4330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9081    4.3360    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2087    3.6914    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2881    4.3360    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9781    2.0670    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6350    2.6230    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2881    4.3360    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9781    3.7990    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2881    1.5300    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1350    1.7570    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320    1.1870    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3671    2.6230    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1760    1.6039    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3291    1.3770    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5560    0.5301    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2101    1.9330    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.8301    1.3130    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4501    1.9330    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3291   -0.6230    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.5622    2.3130    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1350   -0.6230    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1592    4.7430    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3291   -2.2430    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.9651    3.1230    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1350   -2.2430    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.5622    5.5530    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9441   -4.0156    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3426   -3.3254    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.6928    5.4080    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.8957    5.4080    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -3.3130    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.6972    4.1230    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2460   -4.9330    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -5.5530    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4860   -4.9330    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3100   -2.8961    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4631   -3.1230    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6900   -3.9700    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.3363    4.3961    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.5632    5.2430    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.7163    5.4700    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.5403    3.4330    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.1603    2.8130    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.7803    3.4330    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  2 12  1  0  0  0  0
  2 41  1  0  0  0  0
  3 13  1  0  0  0  0
  3 42  1  0  0  0  0
  4 10  1  0  0  0  0
  5 10  2  0  0  0  0
  6 12  2  0  0  0  0
  7 13  2  0  0  0  0
  8 43  1  0  0  0  0
  8 44  1  0  0  0  0
  9 45  1  0  0  0  0
  9 46  1  0  0  0  0
 11 38  1  0  0  0  0
 11 39  1  0  0  0  0
 11 40  1  0  0  0  0
 12 14  1  0  0  0  0
 13 15  1  0  0  0  0
 14 16  1  0  0  0  0
 14 18  1  0  0  0  0
 14 47  1  0  0  0  0
 15 17  1  0  0  0  0
 15 19  1  0  0  0  0
 15 48  1  0  0  0  0
 16 20  2  0  0  0  0
 16 22  1  0  0  0  0
 17 21  2  0  0  0  0
 17 23  1  0  0  0  0
 18 49  1  0  0  0  0
 18 50  1  0  0  0  0
 18 51  1  0  0  0  0
 19 52  1  0  0  0  0
 19 53  1  0  0  0  0
 19 54  1  0  0  0  0
 20 24  1  0  0  0  0
 20 55  1  0  0  0  0
 21 25  1  0  0  0  0
 21 56  1  0  0  0  0
 22 26  2  0  0  0  0
 22 57  1  0  0  0  0
 23 27  2  0  0  0  0
 23 58  1  0  0  0  0
 24 28  2  0  0  0  0
 24 59  1  0  0  0  0
 25 29  2  0  0  0  0
 25 60  1  0  0  0  0
 26 28  1  0  0  0  0
 26 61  1  0  0  0  0
 27 29  1  0  0  0  0
 27 62  1  0  0  0  0
 28 30  1  0  0  0  0
 29 31  1  0  0  0  0
 30 32  1  0  0  0  0
 30 63  1  0  0  0  0
 30 64  1  0  0  0  0
 31 33  1  0  0  0  0
 31 65  1  0  0  0  0
 31 66  1  0  0  0  0
 32 34  1  0  0  0  0
 32 35  1  0  0  0  0
 32 67  1  0  0  0  0
 33 36  1  0  0  0  0
 33 37  1  0  0  0  0
 33 68  1  0  0  0  0
 34 69  1  0  0  0  0
 34 70  1  0  0  0  0
 34 71  1  0  0  0  0
 35 72  1  0  0  0  0
 35 73  1  0  0  0  0
 35 74  1  0  0  0  0
 36 75  1  0  0  0  0
 36 76  1  0  0  0  0
 36 77  1  0  0  0  0
 37 78  1  0  0  0  0
 37 79  1  0  0  0  0
 37 80  1  0  0  0  0
M  CHG  4   4  -1   8  -1   9  -1  11  -1
M  END
> <PUBCHEM_COMPOUND_CID>
58919215

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
516

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
10

> <PUBCHEM_CACTVS_HBOND_DONOR>
4

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
8

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADcfB7OAAAAAAAAAAABAAAAAAAAAAAAAAwYAAAAAAAAAABQAAAGgAUCAAADQCAmAAyCIAAQgCJAiDSCQACAAAgAAAIiAEAAIgIIDKAFRCAYAAkwAEIiAeIyOCOwAAAAAAAAACAAAAAAAAAAAAAAAAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
azanide;carbanide;2-(4-isobutylphenyl)propanoic acid;platinum;nitrite

> <PUBCHEM_IUPAC_CAS_NAME>
azanide;carbanide;2-[4-(2-methylpropyl)phenyl]propanoic acid;platinum;nitrite

> <PUBCHEM_IUPAC_NAME_MARKUP>
azanide;carbanide;2-[4-(2-methylpropyl)phenyl]propanoic acid;platinum;nitrite

> <PUBCHEM_IUPAC_NAME>
azanide;carbanide;2-[4-(2-methylpropyl)phenyl]propanoic acid;platinum;nitrite

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
azanide;carbanide;2-[4-(2-methylpropyl)phenyl]propanoic acid;platinum;nitrite

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
azanide;carbanide;2-(4-isobutylphenyl)propionic acid;platinum;nitrite

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/2C13H18O2.CH3.HNO2.2H2N.Pt/c2*1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15;;2-1-3;;;/h2*4-7,9-10H,8H2,1-3H3,(H,14,15);1H3;(H,2,3);2*1H2;/q;;-1;;2*-1;/p-1

> <PUBCHEM_IUPAC_INCHIKEY>
VXUQWMRWEFFDHB-UHFFFAOYSA-M

> <PUBCHEM_EXACT_MASS>
700.279980

> <PUBCHEM_MOLECULAR_FORMULA>
C27H43N3O6Pt-4

> <PUBCHEM_MOLECULAR_WEIGHT>
700.7

> <PUBCHEM_OPENEYE_CAN_SMILES>
[CH3-].CC(C)CC1=CC=C(C=C1)C(C)C(=O)O.CC(C)CC1=CC=C(C=C1)C(C)C(=O)O.[NH2-].[NH2-].N(=O)[O-].[Pt]

> <PUBCHEM_OPENEYE_ISO_SMILES>
[CH3-].CC(C)CC1=CC=C(C=C1)C(C)C(=O)O.CC(C)CC1=CC=C(C=C1)C(C)C(=O)O.[NH2-].[NH2-].N(=O)[O-].[Pt]

> <PUBCHEM_CACTVS_TPSA>
129

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
700.279980

> <PUBCHEM_TOTAL_CHARGE>
-4

> <PUBCHEM_HEAVY_ATOM_COUNT>
37

> <PUBCHEM_ATOM_DEF_STEREO_COUNT>
0

> <PUBCHEM_ATOM_UDEF_STEREO_COUNT>
2

> <PUBCHEM_BOND_DEF_STEREO_COUNT>
0

> <PUBCHEM_BOND_UDEF_STEREO_COUNT>
0

> <PUBCHEM_ISOTOPIC_ATOM_COUNT>
0

> <PUBCHEM_COMPONENT_COUNT>
7

> <PUBCHEM_CACTVS_TAUTO_COUNT>
-1

> <PUBCHEM_NONSTANDARDBOND>
1  10  6
1  11  6
1  2  6
1  3  6
1  8  6
1  9  6

> <PUBCHEM_COORDINATE_TYPE>
1
5
255

> <PUBCHEM_BONDANNOTATIONS>
14  18  3
15  19  3
16  20  8
16  22  8
17  21  8
17  23  8
20  24  8
21  25  8
22  26  8
23  27  8
24  28  8
25  29  8
26  28  8
27  29  8

$$$$