Compound 370
  CheckMol                        TMF02:r0:m0
MF=C27H46O MW=386.66
 28 31  0 10  1               999 V2000
    0.0000   -0.0000   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4486    1.4403   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5667    2.5618   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9007    1.7590   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1181    4.0020   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3493    3.1993   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1333    5.1236   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3340    4.3208   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6847    6.5638   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7826    5.7610   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7861    4.6395   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7674    6.8826   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2347    6.0798   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2160    8.3228   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6833    7.5201   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6680    8.6416   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4604    9.6332   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8097   10.1409   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0847    9.1138   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4521   10.7547   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0965   10.8964   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3833   10.1527   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0847   12.4075   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6701   10.9082   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9569   10.1645   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2436   10.9200   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5304   10.1763   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2318   12.4311   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  6  0  0  0
  2  3  1  0  1  0  0
  2  4  1  0  1  0  0
  3  5  1  0  1  0  0
  4  6  1  0  1  0  0
  5  7  2  0  1  0  0
  5  8  1  0  2  0  0
  7  9  1  0  1  0  0
  8 10  1  0  1  0  0
  8 11  1  6  0  0  0
 12  9  1  1  1  0  0
 10 13  1  6  1  0  0
 12 14  1  0  1  0  0
 13 15  1  0  1  0  0
 14 16  1  0  2  0  0
 14 17  1  6  1  0  0
 16 18  1  0  1  0  0
 16 19  1  6  0  0  0
 17 20  1  0  1  0  0
 18 21  1  0  0  0  0
 21 22  1  0  0  0  0
 21 23  1  6  0  0  0
 22 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 26 28  1  0  0  0  0
  6  8  1  0  1  0  0
 10 12  1  0  2  0  0
 15 16  1  0  1  0  0
 18 20  1  6  1  0  0
M  END

2D Structure

Cholestrol

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Chemical Name - Cholestrol
Mol Weight - 386.661
Smiles - CC(C)CCC[C@@H](C)[C@@H](CC1)[C@@](C)(CC2)[C@@H]1[C@H]1[C@H]2[C@@](C)(CC[C@@H](C2)O)C2=CC1

Property Name	Property Value
Mol Name	Cholestrol
Molweight	386.661
Monoisotopic Mass	386.354865
Clogp	7.1825
Clogs	-6.239
H Acceptors	1
H Donors	1
Total Surface Area	311.54
Relative Psa	0.042049
Polar Surface Area	20.23
Druglikeness	-2.132
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Shape Index	0.57143
Molecular Flexibility	0.2904
Molecular Complexity	0.92172
Fragments	1
Non H Atoms	28
Non Ch Atoms	1
Electronegative Atoms	1
Stereo Centers	8
Rotatable Bonds	5
Rings Closures	4
Small Rings	4
Sp3 Atoms	26
Symmetric Atoms	1
Smiles	CC(C)CCC[C@@H](C)[C@@H](CC1)[C@@](C)(CC2)[C@@H]1[C@H]1[C@H]2[C@@](C)(CC[C@@H](C2)O)C2=CC1
InChIKey	InChI=1S/C27H46O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9,18-19,21-25,28H,6-8,10-17H2,1-5H3/t19-,21+,22-,23+,24+,25-,26+,27-/m1/s1
InChI	HVYWMOMLDIMFJA-LZRBQCDVSA-N

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1 — Cholestrol | 2 — Cholestrol