5373727
  DSViewer          3D                             0

 39 39  0  0  0  0  0  0  0  0999 V2000
    5.6107    0.3888    0.1444 C   0  0  3  0  0  0  0  0  0  1
    7.1543    0.0362    0.0039 C   0  0  0  0  0  0  0  0  0  2
    4.6946   -0.3837   -0.8891 C   0  0  0  0  0  0  0  0  0  3
    4.2988   -1.8358   -0.5066 C   0  0  0  0  0  0  0  0  0  4
    5.4415    1.8844   -0.1413 C   0  0  0  0  0  0  0  0  0  5
    7.5988    0.3659   -1.4401 C   0  0  0  0  0  0  0  0  0  6
    7.5106   -1.4384    0.3038 C   0  0  0  0  0  0  0  0  0  7
    2.7536   -2.1329   -0.2136 C   0  0  0  0  0  0  0  0  0  8
    4.3179    2.6448   -0.0573 C   0  0  0  0  0  0  0  0  0  9
    1.6152    0.2619   -0.2319 C   0  0  0  0  0  0  0  0  0 10
    1.6926   -1.2757   -0.1163 C   0  0  0  0  0  0  0  0  0 11
    2.3957    0.9835    0.9035 C   0  0  0  0  0  0  0  0  0 12
    2.8572    2.3237    0.3533 C   0  0  0  0  0  0  0  0  0 13
    2.4081   -3.5848   -0.0588 C   0  0  0  0  0  0  0  0  0 14
    1.9326    3.2437    0.1050 C   0  0  0  0  0  0  0  0  0 15
    5.2384    0.2014    1.1641 H   0  0  0  0  0  0  0  0  0 16
    7.7242    0.6636    0.7026 H   0  0  0  0  0  0  0  0  0 17
    3.7757    0.1896   -1.0114 H   0  0  0  0  0  0  0  0  0 18
    5.2273   -0.4242   -1.8392 H   0  0  0  0  0  0  0  0  0 19
    4.6046   -2.4836   -1.3281 H   0  0  0  0  0  0  0  0  0 20
    4.8569   -2.0994    0.3918 H   0  0  0  0  0  0  0  0  0 21
    6.3439    2.4097   -0.4540 H   0  0  0  0  0  0  0  0  0 22
    8.5838   -1.5853    0.1826 H   0  0  0  0  0  0  0  0  0 23
    6.9751   -2.0898   -0.3869 H   0  0  0  0  0  0  0  0  0 24
    7.2245   -1.6810    1.3272 H   0  0  0  0  0  0  0  0  0 25
    8.6566    0.1308   -1.5578 H   0  0  0  0  0  0  0  0  0 26
    7.4387    1.4260   -1.6370 H   0  0  0  0  0  0  0  0  0 27
    7.0150   -0.2264   -2.1447 H   0  0  0  0  0  0  0  0  0 28
    4.4746    3.6875   -0.3336 H   0  0  0  0  0  0  0  0  0 29
    2.0365    0.5621   -1.1913 H   0  0  0  0  0  0  0  0  0 30
    0.5689    0.5639   -0.1835 H   0  0  0  0  0  0  0  0  0 31
    0.7363   -1.7621    0.0760 H   0  0  0  0  0  0  0  0  0 32
    1.7446    1.1377    1.7640 H   0  0  0  0  0  0  0  0  0 33
    3.2573    0.3861    1.2017 H   0  0  0  0  0  0  0  0  0 34
    1.3406   -3.6860    0.1370 H   0  0  0  0  0  0  0  0  0 35
    2.9712   -4.0060    0.7741 H   0  0  0  0  0  0  0  0  0 36
    2.6612   -4.1187   -0.9748 H   0  0  0  0  0  0  0  0  0 37
    2.2127    4.1834   -0.3710 H   0  0  0  0  0  0  0  0  0 38
    0.8934    3.0593    0.3773 H   0  0  0  0  0  0  0  0  0 39
  1  2  1  0  0  0
  1  3  1  0  0  0
  1  5  1  0  0  0
  1 16  1  0  0  0
  2  6  1  0  0  0
  2  7  1  0  0  0
  2 17  1  0  0  0
  3  4  1  0  0  0
  3 18  1  0  0  0
  3 19  1  0  0  0
  4  8  1  0  0  0
  4 20  1  0  0  0
  4 21  1  0  0  0
  5  9  2  0  0  0
  5 22  1  0  0  0
  6 26  1  0  0  0
  6 27  1  0  0  0
  6 28  1  0  0  0
  7 23  1  0  0  0
  7 24  1  0  0  0
  7 25  1  0  0  0
  8 11  2  0  0  0
  8 14  1  0  0  0
  9 13  1  0  0  0
  9 29  1  0  0  0
 10 11  1  0  0  0
 10 12  1  0  0  0
 10 30  1  0  0  0
 10 31  1  0  0  0
 11 32  1  0  0  0
 12 13  1  0  0  0
 12 33  1  0  0  0
 12 34  1  0  0  0
 13 15  2  0  0  0
 14 35  1  0  0  0
 14 36  1  0  0  0
 14 37  1  0  0  0
 15 38  1  0  0  0
 15 39  1  0  0  0
M  END
> <PUBCHEM_COMPOUND_CID>
5373727

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
266

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
0

> <PUBCHEM_CACTVS_HBOND_DONOR>
0

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
1

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADceBwAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACAAAAAGAAAAAAADQCAAAACAAAAAACAAiBCAAAAAAAgAAAICAAAAAgIAAIAAQAAAAAAgAAIgAMAgEAOgAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
(1Z,6Z)-8-isopropyl-1-methyl-5-methylene-cyclodeca-1,6-diene

> <PUBCHEM_IUPAC_CAS_NAME>
(1Z,6Z)-1-methyl-5-methylene-8-propan-2-ylcyclodeca-1,6-diene

> <PUBCHEM_IUPAC_NAME>
(1Z,6Z)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
(1Z,6Z)-1-methyl-5-methylidene-8-propan-2-yl-cyclodeca-1,6-diene

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
(1Z,6Z)-8-isopropyl-1-methyl-5-methylene-cyclodeca-1,6-diene

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/C15H24/c1-12(2)15-10-8-13(3)6-5-7-14(4)9-11-15/h7-8,10,12,15H,3,5-6,9,11H2,1-2,4H3/b10-8-,14-7-

> <PUBCHEM_IUPAC_INCHIKEY>
GAIBLDCXCZKKJE-BZXLUOIMSA-N

> <PUBCHEM_XLOGP3_AA>
4.7

> <PUBCHEM_EXACT_MASS>
204.188

> <PUBCHEM_MOLECULAR_FORMULA>
C15H24

> <PUBCHEM_MOLECULAR_WEIGHT>
204.351

> <PUBCHEM_OPENEYE_CAN_SMILES>
CC1=CCCC(=C)C=CC(CC1)C(C)C

> <PUBCHEM_OPENEYE_ISO_SMILES>
C/C/1=C/CCC(=C)/C=C\C(CC1)C(C)C

> <PUBCHEM_CACTVS_TPSA>
0

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
204.188

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_HEAVY_ATOM_COUNT>
15

> <PUBCHEM_ATOM_DEF_STEREO_COUNT>
0

> <PUBCHEM_ATOM_UDEF_STEREO_COUNT>
1

> <PUBCHEM_BOND_DEF_STEREO_COUNT>
2

> <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>
1  2  3

$$$$
