70150300
  -OEChem-05072409342D

 43 47  0     1  0  0  0  0  0999 V2000
    2.0000   -0.8268    0.0000 Si  0  0  0  0  0  1  0  0  0  0  0  0
    5.5122    4.8485    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.4061    3.2745    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8981    3.2792    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2822    4.8243    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3579   -4.3452    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7642    1.7792    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.0417   -0.5214    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.4062    3.2861    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.4962    2.7792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6302    1.2792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6302    3.2792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0271    1.1121    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4962    1.7792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4322    0.2043    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4210    0.3074    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7642    2.7792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8962    2.4143    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6141    4.3207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4142    4.3277    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9957   -0.7346    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5972   -1.5775    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3862    1.5541    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6270   -1.4702    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1425   -2.5556    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2736   -2.3334    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7690   -3.4336    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8417   -3.3217    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6617    1.6130    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4906    0.8014    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0331    1.4692    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3665    2.0103    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3757    2.8073    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3961    4.9011    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0050    4.2052    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8529    1.8703    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0700    1.0208    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9195    1.2379    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7099    2.7340    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5251   -2.6127    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8895   -2.2620    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2076   -3.8222    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7200   -4.8485    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 21  1  0  0  0  0
  2 19  1  0  0  0  0
  2 20  1  0  0  0  0
  9  3  1  1  0  0  0
  3 39  1  0  0  0  0
  4 17  2  0  0  0  0
  5 20  2  0  0  0  0
  6 27  1  0  0  0  0
  6 43  1  0  0  0  0
  7 11  1  0  0  0  0
  7 13  1  0  0  0  0
  7 17  1  0  0  0  0
  8 16  2  0  0  0  0
  8 24  1  0  0  0  0
  9 10  1  0  0  0  0
  9 18  1  0  0  0  0
  9 20  1  0  0  0  0
 10 12  2  0  0  0  0
 10 14  1  0  0  0  0
 11 14  2  0  0  0  0
 11 16  1  0  0  0  0
 12 17  1  0  0  0  0
 12 19  1  0  0  0  0
 13 15  1  0  0  0  0
 13 29  1  0  0  0  0
 13 30  1  0  0  0  0
 14 31  1  0  0  0  0
 15 16  1  0  0  0  0
 15 21  2  0  0  0  0
 18 23  1  0  0  0  0
 18 32  1  0  0  0  0
 18 33  1  0  0  0  0
 19 34  1  0  0  0  0
 19 35  1  0  0  0  0
 21 22  1  0  0  0  0
 22 24  2  0  0  0  0
 22 25  1  0  0  0  0
 23 36  1  0  0  0  0
 23 37  1  0  0  0  0
 23 38  1  0  0  0  0
 24 26  1  0  0  0  0
 25 27  2  0  0  0  0
 25 40  1  0  0  0  0
 26 28  2  0  0  0  0
 26 41  1  0  0  0  0
 27 28  1  0  0  0  0
 28 42  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_CID>
70150300

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
810

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
6

> <PUBCHEM_CACTVS_HBOND_DONOR>
2

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
1

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADccB7OAgAAAAAAAAAAAAAAAAAAWAAAAA8QIEAAAAAAFix8AAAHhAACAAADEzhvgYyzvMIFgCoAyXyXAKCgCAhIiAImCF+bNgJZvbC8ZOWcAhm5hHL+QewwPAOAEABAAACAAAAgAIAAAQAAAAAAAAAAA==

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/C20H15N2O5Si/c1-2-20(26)13-6-15-16-11(7-22(15)18(24)12(13)8-27-19(20)25)17(28)10-5-9(23)3-4-14(10)21-16/h3-6,23,26H,2,7-8H2,1H3/t20-/m0/s1

> <PUBCHEM_IUPAC_INCHIKEY>
BXISFZNINCBQOY-FQEVSTJZSA-N

> <PUBCHEM_EXACT_MASS>
391.07502312

> <PUBCHEM_MOLECULAR_FORMULA>
C20H15N2O5Si

> <PUBCHEM_MOLECULAR_WEIGHT>
391.4

> <PUBCHEM_OPENEYE_CAN_SMILES>
CCC1(C2=C(COC1=O)C(=O)N3CC4=C(C5=C(C=CC(=C5)O)N=C4C3=C2)[Si])O

> <PUBCHEM_OPENEYE_ISO_SMILES>
CC[C@@]1(C2=C(COC1=O)C(=O)N3CC4=C(C5=C(C=CC(=C5)O)N=C4C3=C2)[Si])O

> <PUBCHEM_CACTVS_TPSA>
100

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
391.07502312

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_HEAVY_ATOM_COUNT>
28

> <PUBCHEM_ATOM_DEF_STEREO_COUNT>
1

> <PUBCHEM_ATOM_UDEF_STEREO_COUNT>
0

> <PUBCHEM_BOND_DEF_STEREO_COUNT>
0

> <PUBCHEM_BOND_UDEF_STEREO_COUNT>
0

> <PUBCHEM_ISOTOPIC_ATOM_COUNT>
0

> <PUBCHEM_COMPONENT_COUNT>
1

> <PUBCHEM_CACTVS_TAUTO_COUNT>
-1

> <PUBCHEM_COORDINATE_TYPE>
1
5
255

> <PUBCHEM_BONDANNOTATIONS>
10  12  8
10  14  8
11  14  8
12  17  8
15  16  8
15  21  8
21  22  8
22  24  8
22  25  8
24  26  8
25  27  8
26  28  8
27  28  8
9  3  5
7  11  8
7  17  8
8  16  8
8  24  8

$$$$