LMPR02020074
  LIPID_MAPS_STRUCTURE_DATABASE

 35 36  0     0  0            999 V2000
    7.4396    8.5605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4396    7.5598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3053    7.0611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1691    7.5598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1691    8.5605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3053    9.0592    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0347    7.0611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8971    7.5598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8971    8.5605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0347    9.0592    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3053   10.0598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5724    9.0609    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7325    6.8544    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3053    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8971    9.5611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7636    9.0609    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6303    8.5605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4968    9.0609    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3634    8.5605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2299    9.0609    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0965    8.5605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9631    9.0609    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.8297    8.5605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.6962    9.0609    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.5628    8.5605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.4294    9.0609    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.2959    8.5605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6224    7.5940    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.3300    7.6940    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3294    7.6940    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.8631    7.6940    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   21.3036    7.5933    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.1856    9.0901    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.0581    8.6017    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   22.1723   10.0900    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
 20 19  1  0  0  0  0
 21 20  1  0  0  0  0
 22 21  1  0  0  0  0
 23 22  1  0  0  0  0
 24 23  1  0  0  0  0
 25 24  1  0  0  0  0
 26 25  1  0  0  0  0
 27 26  1  0  0  0  0
 19 28  1  1  0  0  0
 23 29  1  1  0  0  0
 23 30  1  6  0  0  0
 19 31  1  6  0  0  0
 27 32  1  0  0  0  0
 27 33  1  0  0  0  0
 33 34  1  0     0  0
 33 35  2  0     0  0
M  END
> <LM_ID>
LMPR02020074

> <COMMON_NAME>
13'-carboxy-alpha-tocopherol

> <SYSTEMATIC_NAME>
(6S,10R)-13-[(2R)-6-hydroxy-2,5,7,8-tetramethyl-3,4-dihydrochromen-2-yl]-2,6,10-trimethyltridecanoic acid

> <FORMULA>
C29H48O4

> <MASS>
460.36

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Quinones and hydroquinones [PR02]

> <SUB_CLASS>
Vitamin E [PR0202]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
13'-carboxychromanol

> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
-

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
155524909

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/index.php/databases/lmsd/LMPR02020074

$$$$