5354168
  -OEChem-11242522202D

 67 66  0     0  0  0  0  0  0999 V2000
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   16.1813    2.1426    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.7828    1.4523    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
> <PUBCHEM_COMPOUND_CID>
5354168

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
222

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
1

> <PUBCHEM_CACTVS_HBOND_DONOR>
1

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
19

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADcfB4IAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAGgAACAAACACggAICAAAAAgCAACBCAAAAAAAgAAAICAAAAAgAEAIAAQAAQAAEgAAIAAOAwKAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
(Z)-docos-13-en-1-ol

> <PUBCHEM_IUPAC_CAS_NAME>
(Z)-13-docosen-1-ol

> <PUBCHEM_IUPAC_NAME_MARKUP>
(<I>Z</I>)-docos-13-en-1-ol

> <PUBCHEM_IUPAC_NAME>
(Z)-docos-13-en-1-ol

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
(Z)-docos-13-en-1-ol

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
(Z)-docos-13-en-1-ol

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/C22H44O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23/h9-10,23H,2-8,11-22H2,1H3/b10-9-

> <PUBCHEM_IUPAC_INCHIKEY>
CFOQKXQWGLAKSK-KTKRTIGZSA-N

> <PUBCHEM_XLOGP3>
9.6

> <PUBCHEM_EXACT_MASS>
324.339216023

> <PUBCHEM_MOLECULAR_FORMULA>
C22H44O

> <PUBCHEM_MOLECULAR_WEIGHT>
324.6

> <PUBCHEM_SMILES>
CCCCCCCC/C=C\CCCCCCCCCCCCO

> <PUBCHEM_CONNECTIVITY_SMILES>
CCCCCCCCC=CCCCCCCCCCCCCO

> <PUBCHEM_CACTVS_TPSA>
20.2

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
324.339216023

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_HEAVY_ATOM_COUNT>
23

> <PUBCHEM_ATOM_DEF_STEREO_COUNT>
0

> <PUBCHEM_ATOM_UDEF_STEREO_COUNT>
0

> <PUBCHEM_BOND_DEF_STEREO_COUNT>
1

> <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

$$$$
