LMPR01070606
  LIPID_MAPS_STRUCTURE_DATABASE

 34 34  0     0  0            999 V2000
    3.5234  -10.1513    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5234  -11.1496    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3877  -11.6489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2524  -11.1496    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2524  -10.1513    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3877   -9.6521    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1349   -9.6521    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9996  -10.1513    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8640   -9.6521    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7287  -10.1513    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5933   -9.6521    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4580  -10.1513    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3227   -9.6521    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1872  -10.1513    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0517   -9.6521    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9163  -10.1513    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7809   -9.6521    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6456  -10.1513    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.5101   -9.6521    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8885   -8.7876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8869   -8.7876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6456  -11.1496    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8640   -8.6538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3227   -8.6538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1164  -11.6485    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3969  -10.1655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.2737   -9.6593    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.1382  -10.1585    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.9972   -9.6624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.1382  -11.1561    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.8876  -10.1765    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6678  -11.6432    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1184  -10.6513    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.9974   -8.6766    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  2  3  1  0     0  0
  3  4  2  0     0  0
  4  5  1  0     0  0
  5  6  1  0     0  0
  1  6  1  0     0  0
  5  7  1  0     0  0
  7  8  2  0     0  0
  8  9  1  0     0  0
  9 10  2  0     0  0
 10 11  1  0     0  0
 11 12  2  0     0  0
 12 13  1  0     0  0
 13 14  2  0     0  0
 14 15  1  0     0  0
 15 16  2  0     0  0
 16 17  1  0     0  0
 17 18  2  0     0  0
 18 19  1  0     0  0
  6 20  1  0     0  0
  6 21  1  0     0  0
 18 22  1  0     0  0
  9 23  1  0     0  0
 13 24  1  0     0  0
  4 25  1  0     0  0
 19 26  2  0     0  0
 26 27  1  0     0  0
 27 28  2  0     0  0
 28 29  1  0     0  0
 28 30  1  0     0  0
 29 31  1  0     0  0
  2 32  2  0     0  0
  5 33  1  0     0  0
 29 34  2  0     0  0
M  END
> <LM_ID>
LMPR01070606

> <COMMON_NAME>
Cochloxanthin

> <SYSTEMATIC_NAME>
6-Hydroxy-3-oxo-8'-apo-epsilon,psi-caroten-8'-oic acid

> <FORMULA>
C30H38O4

> <MASS>
462.28

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

> <SUB_CLASS>
C40 isoprenoids (tetraterpenes) [PR0107]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
GEXJMFRWDKABED-ILNMZGKRSA-N

> <INCHI>
InChI=1S/C30H38O4/c1-22(12-8-9-13-23(2)16-11-17-25(4)28(32)33)14-10-15-24(3)18-19-30(34)26(5)20-27(31)21-29(30,6)7/h8-20,34H,21H2,1-7H3,(H,32,33)/b9-8+,14-10+,16-11+,19-18+,22-12+,23-13+,24-15+,25-17+

> <SMILES>
C1C(C)(C)C(O)(/C=C/C(/C)=C/C=C/C(/C)=C/C=C/C=C(\C)/C=C/C=C(\C)/C(=O)O)C(C)=CC1=O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
14160632

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
66675

> <CITATION>
-

$$$$