LMPR01070113
  LIPID_MAPS_STRUCTURE_DATABASE

 41 40  0     0  0            999 V2000
    9.4090    8.4373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2841    7.9455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1168    8.4373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1168    9.4206    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7110    9.8370    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7110    8.4373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5601    7.9455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9820    7.9455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8342    8.4373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6734    7.9455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5287    8.4373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5287    9.4206    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   33.3104    8.4373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   32.4582    7.9455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3778    7.9455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2364    8.4373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.3384    7.9455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.4829    8.4373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.0921    7.9455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.9410    8.4373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.9410    9.4206    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.7999    7.9455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.6554    8.4373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.4844    7.9455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.3433    8.4373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.2121    7.9455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.0673    8.4373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.2121    6.9621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.9196    7.9455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.6273    7.9455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.6273    6.9621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.7587    8.4373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.0463    6.9621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.0463    7.9455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   28.2105    8.4373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   30.7474    7.9455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.8753    8.4373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   32.4582    6.9621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   31.6029    8.4373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8557    7.9455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6621    8.9848    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  1  7  1  0  0  0  0
  3  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 13 14  1  0  0  0  0
 11 15  2  0  0  0  0
 15 16  1  0  0  0  0
 17 18  1  0  0  0  0
 16 19  2  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 20 22  2  0  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
 24 25  1  0  0  0  0
 25 26  2  0  0  0  0
 26 27  1  0  0  0  0
 26 28  1  0  0  0  0
 27 29  2  0  0  0  0
 30 31  1  0  0  0  0
 30 32  2  0  0  0  0
 29 32  1  0  0  0  0
 18 30  1  0  0  0  0
 33 34  1  0  0  0  0
 34 35  2  0  0  0  0
 17 35  1  0  0  0  0
 36 37  1  0  0  0  0
 34 37  1  0  0  0  0
 14 38  1  0  0  0  0
 14 39  2  0  0  0  0
 36 39  1  0  0  0  0
  6 40  1  0  0  0  0
  6 41  1  0  0  0  0
M  END
> <LM_ID>
LMPR01070113

> <COMMON_NAME>
Chloroxanthin

> <SYSTEMATIC_NAME>
1,2,7',8'-Tetrahydro-psi,psi-caroten-1-ol

> <FORMULA>
C40H60O

> <MASS>
556.46

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

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

> <CLASS_LEVEL4>
-

> <SYNONYMS>
Hydroxyneurosporene; OH-Neurosporene

> <INCHI_KEY>
IWZRTQIXVDXLNL-PZKADDIDSA-N

> <INCHI>
InChI=1S/C40H60O/c1-33(2)19-13-22-36(5)25-16-28-37(6)26-14-23-34(3)20-11-12-21-35(4)24-15-27-38(7)29-17-30-39(8)31-18-32-40(9,10)41/h11-12,14-15,17,19-21,23-27,29-30,41H,13,16,18,22,28,31-32H2,1-10H3/b12-11+,23-14+,24-15+,29-17+,34-20+,35-21+,36-25+,37-26+,38-27+,39-30+

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

> <KEGG_ID>
C15892

> <HMDB_ID>
-

> <CHEBI_ID>
138077

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
9915740

> <LIPIDBANK_ID>
VCA1031

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
1085

> <CITATION>
-

$$$$