LMPR01070789
  LIPID_MAPS_STRUCTURE_DATABASE

 43 44  0     0  0            999 V2000
    2.6393  -11.0515    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6393  -12.0526    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5062  -12.5531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3732  -12.0526    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3732  -11.0515    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5062  -10.5510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0057   -9.6841    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0067   -9.6841    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7723  -12.5531    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8737  -12.9195    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3401  -11.7936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2581  -10.5510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1251  -11.0515    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9920  -10.5510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8589  -11.0515    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7259  -10.5510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5928  -11.0515    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4597  -10.5510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3267  -11.0515    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1937  -10.5510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0607  -11.0515    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9276  -10.5510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7945  -11.0515    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6615  -10.5510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.5284  -11.0515    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3954  -10.5510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.2624  -11.0515    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9920   -9.5499    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4597   -9.5500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7945  -12.0526    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.1245  -10.5538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.9770  -11.0460    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.2624  -12.0526    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.8271  -10.5552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.6784  -11.0468    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.5454  -10.5463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.5454   -9.5452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.6942   -9.0536    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.8272   -9.5541    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.6784  -12.0525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.4216   -9.0393    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.8602   -9.2950    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.3266   -8.6872    0.0000 C   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  1  0     0  0
  4  5  1  0     0  0
  5  6  1  0     0  0
  1  6  1  0     0  0
  6  7  1  0     0  0
  6  8  1  0     0  0
  2  9  2  0     0  0
  4 10  1  0     0  0
  4 11  1  0     0  0
  5 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
 19 20  2  0     0  0
 20 21  1  0     0  0
 21 22  2  0     0  0
 22 23  1  0     0  0
 23 24  2  0     0  0
 24 25  1  0     0  0
 25 26  2  0     0  0
 26 27  1  0     0  0
 14 28  1  0     0  0
 18 29  1  0     0  0
 23 30  1  0     0  0
 27 31  2  0     0  0
 31 32  1  0     0  0
 27 33  1  0     0  0
 32 34  2  0     0  0
 34 35  1  0     0  0
 35 36  2  0     0  0
 36 37  1  0     0  0
 37 38  1  0     0  0
 38 39  1  0     0  0
 34 39  1  0     0  0
 35 40  1  0     0  0
 37 41  2  0     0  0
 39 42  1  0     0  0
 39 43  1  0     0  0
M  END
> <LM_ID>
LMPR01070789

> <COMMON_NAME>
Loniceraxanthin

> <SYSTEMATIC_NAME>
5-Hydroxy-4',5'-didehydro-4,5-dihydro-4,5'-retro-beta,beta-carotene-3,3'-dione

> <FORMULA>
C40H52O3

> <MASS>
580.39

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

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

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
PJXHCRLUGLXAPA-CPQWCQCSSA-N

> <INCHI>
InChI=1S/C40H52O3/c1-29(17-13-19-31(3)21-23-36-33(5)25-34(41)26-38(36,6)7)15-11-12-16-30(2)18-14-20-32(4)22-24-37-39(8,9)27-35(42)28-40(37,10)43/h11-25,43H,26-28H2,1-10H3/b15-11+,16-12+,19-13+,20-14+,29-17+,30-18+,31-21+,32-22+,36-23-,37-24+

> <SMILES>
C1C(C)(O)/C(=C/C=C(\C)/C=C/C=C(\C)/C=C/C=C/C(/C)=C/C=C/C(/C)=C/C=C2\C(C)(C)CC(=O)C=C\2C)/C(C)(C)CC1=O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
171120466

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
1043444

> <CITATION>
-

$$$$