54749138
  -OEChem-04262420052D

 16 20  0     1  0  0  0  0  0999 V2000
    2.5000   -1.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5000   -4.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    0.0000    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.0000   -6.3500    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.5000   -2.3500    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.5000   -3.8000    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.5000   -2.1500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5000   -4.3500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8193   -1.3202    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8773   -4.2718    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5000   -2.0000    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -8.3500    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5000   -4.1500    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0000   -6.1500    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8863   -1.9289    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8933   -4.5215    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  3  1  1  1  0  0  0
  5  1  1  6  0  0  0
  1  9  1  0  0  0  0
  4  2  1  1  0  0  0
  6  2  1  6  0  0  0
  2 10  1  0  0  0  0
  3  5  1  0  0  0  0
  3  7  1  0  0  0  0
  3 11  1  0  0  0  0
  4  6  1  0  0  0  0
  4  8  1  0  0  0  0
  4 12  1  0  0  0  0
  5  8  1  0  0  0  0
  5 13  1  0  0  0  0
  6  7  1  0  0  0  0
  6 14  1  0  0  0  0
  7  8  1  0  0  0  0
  7 15  1  0  0  0  0
  8 16  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_CID>
54749138

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
176

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
0

> <PUBCHEM_CACTVS_HBOND_DONOR>
0

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
0

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADccBwAAAAAAAAAAAAAAAAGDBgwYMAAAAAAAAAAAAAAAAAAAAAGAAAAAAADQCAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAIAAAAAAAAAAAAAAAEAgMAOgAAAAAAAAACAAAQAACAAAQAACAAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
(2R,4R,6R,8R)-pentacyclo[3.3.0.02,4.03,7.06,8]octane

> <PUBCHEM_IUPAC_CAS_NAME>
(2R,4R,6R,8R)-pentacyclo[3.3.0.02,4.03,7.06,8]octane

> <PUBCHEM_IUPAC_NAME_MARKUP>
(2<I>R</I>,4<I>R</I>,6<I>R</I>,8<I>R</I>)-pentacyclo[3.3.0.0<SUP>2,4</SUP>.0<SUP>3,7</SUP>.0<SUP>6,8</SUP>]octane

> <PUBCHEM_IUPAC_NAME>
(2R,4R,6R,8R)-pentacyclo[3.3.0.02,4.03,7.06,8]octane

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
(2R,4R,6R,8R)-pentacyclo[3.3.0.02,4.03,7.06,8]octane

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
(2R,4R,6R,8R)-pentacyclo[3.3.0.02,4.03,7.06,8]octane

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/C8H8/c1-2-5(1)6-3-4(6)8(2)7(1)3/h1-8H/t1-,2-,3-,4-,5?,6?,7?,8?/m1/s1

> <PUBCHEM_IUPAC_INCHIKEY>
YIJMEXRVJPVGIY-QYEJKOAVSA-N

> <PUBCHEM_XLOGP3_AA>
1.2

> <PUBCHEM_EXACT_MASS>
104.062600255

> <PUBCHEM_MOLECULAR_FORMULA>
C8H8

> <PUBCHEM_MOLECULAR_WEIGHT>
104.15

> <PUBCHEM_OPENEYE_CAN_SMILES>
C12C3C4C3C5C4C1C25

> <PUBCHEM_OPENEYE_ISO_SMILES>
[C@@H]12[C@@H]3C1C4[C@H]5[C@H]4C3C25

> <PUBCHEM_CACTVS_TPSA>
0

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
104.062600255

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_HEAVY_ATOM_COUNT>
8

> <PUBCHEM_ATOM_DEF_STEREO_COUNT>
4

> <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>
3  1  5
5  1  6
4  2  5
6  2  6

$$$$