Mrv1652309121723102D          

 20 19  0  0  0  0            999 V2000
    4.4395   -0.3017    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    3.6168   -0.3017    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.2659   -0.3017    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4361    0.5211    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4361   -1.1278    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9037    0.1063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1907   -0.2983    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4775    0.1165    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7646   -0.2949    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4742    0.9392    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0514    0.1200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7611   -0.2949    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4775    0.1200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1907   -0.2949    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4844    0.9427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9620    0.1200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6752   -0.2949    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3915    0.1200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1081   -0.2949    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3950    0.9427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  1  5  2  0  0  0  0
  2  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  0  0  0  0
  9 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 13 15  1  0  0  0  0
 14 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 18 20  1  0  0  0  0
M  STY  1   1 SRU
M  SCN  1   1 HT 
M  SAL   1  5  11  12  13  14  15
M  SDI   1  4   -2.5848   -0.4697   -2.5848    0.3360
M  SDI   1  4    0.3189    0.3360    0.3189   -0.4697
M  SBL   1  2  10  15
M  SMT   1 n
M  END
> <DATABASE_ID>
FDB023901

> <DATABASE_NAME>
foodb

> <SMILES>
CC(CCOP(O)(O)=O)CC\C=C(/C)CCC=C(C)C

> <INCHI_IDENTIFIER>
InChI=1S/C15H29O4P/c1-13(2)7-5-8-14(3)9-6-10-15(4)11-12-19-20(16,17)18/h7,9,15H,5-6,8,10-12H2,1-4H3,(H2,16,17,18)/b14-9+

> <INCHI_KEY>
DZHSRPJGCZHWOM-NTEUORMPSA-N

> <FORMULA>
(C5H8)nC10H21O4P

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <ALOGPS_LOGP>
3.40

> <ALOGPS_LOGS>
-3.80

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
4.85e-02 g/l

> <FOODB_ID>
FDB023901

> <GENERIC_NAME>
Dolichol phosphate

$$$$