LMPR02020083
  LIPID_MAPS_STRUCTURE_DATABASE

 24 25  0     0  0            999 V2000
    7.4453    8.5671    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4453    7.5656    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3116    7.0665    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1762    7.5656    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1762    8.5671    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3116    9.0660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0424    7.0665    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9054    7.5656    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9054    8.5671    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0424    9.0660    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3116   10.0675    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5773    9.0677    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7377    6.8597    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3116    6.0653    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9054    9.5684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7726    9.0677    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6399    8.5671    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5071    9.0677    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3742    8.5671    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.5071   10.0681    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.2405    9.0672    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   15.6815    8.2671    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.7905    9.7922    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.0245    9.5172    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  1  6  2  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
  5 10  1  0  0  0  0
  6 11  1  0  0  0  0
  1 12  1  0  0  0  0
  2 13  1  0  0  0  0
  3 14  1  0  0  0  0
  9 15  1  1  0  0  0
 16  9  1  0  0  0  0
 17 16  1  0  0  0  0
 18 17  1  0  0  0  0
 19 18  1  0  0  0  0
 18 20  2  0     0  0
 19 21  1  0     0  0
 21 22  2  0     0  0
 21 23  2  0     0  0
 21 24  1  0     0  0
M  END
> <LM_ID>
LMPR02020083

> <COMMON_NAME>
alpha-carboxyethylhydroxychroman sulfate

> <SYSTEMATIC_NAME>
5-[(2R)-6-Hydroxy-2,5,7,8-tetramethyl-3,4-dihydrochromen-2-yl]-propanoyl-sulfate

> <FORMULA>
C16H22O7S

> <MASS>
358.11

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Quinones and hydroquinones [PR02]

> <SUB_CLASS>
Vitamin E [PR0202]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
CEHC sulfate

> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
-

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
171119213

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMPR02020083

$$$$