LMPR01070603
  LIPID_MAPS_STRUCTURE_DATABASE

 39 39  0     0  0            999 V2000
    4.3009  -10.5588    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3009  -11.5571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1653  -12.0564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0300  -11.5571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0300  -10.5588    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1653  -10.0595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9124  -10.0595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7772  -10.5588    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6416  -10.0595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5063  -10.5588    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3709  -10.0595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2356  -10.5588    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1002  -10.0595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9647  -10.5588    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8292  -10.0595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6938  -10.5588    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5584  -10.0595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4232  -10.5588    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.2875  -10.0595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6662   -9.1951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6645   -9.1951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4232  -11.5571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6416   -9.0613    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1002   -9.0614    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8940  -12.0560    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4366  -12.0561    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.1743  -10.5729    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.0512  -10.0667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.9279  -10.5729    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.8047  -10.0667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.6708  -10.5668    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8976  -11.0596    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   22.5286  -10.0715    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.6708  -11.5635    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.9282  -11.5523    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.0718  -12.0471    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.0720  -13.0538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.9534  -13.5627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.2195  -13.5463    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  6     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
  2 26  2  0     0  0
 19 27  2  0     0  0
 27 28  1  0     0  0
 28 29  1  0     0  0
 29 30  2  0     0  0
 30 31  1  0     0  0
  5 32  1  1     0  0
 31 33  1  0     0  0
 31 34  2  0     0  0
 29 35  1  0     0  0
 35 36  1  0     0  0
 36 37  1  0     0  0
 37 38  1  0     0  0
 37 39  2  0     0  0
M  END
> <LM_ID>
LMPR01070603

> <COMMON_NAME>
Vitixanthin

> <SYSTEMATIC_NAME>
(6R)-19'-Ethanoyloxy-6-hydroxy-3-oxo-8',9'-didehydro-7',8',9',10'-tetrahydro-7'-apo-epsilon,psi-caroten-7'-oic acid

> <FORMULA>
C33H42O6

> <MASS>
534.30

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

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

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
PXIAYYSYXOBGLA-IYHIIZRQSA-N

> <INCHI>
InChI=1S/C33H42O6/c1-24(12-8-9-13-25(2)16-11-17-29(21-31(36)37)23-39-28(5)34)14-10-15-26(3)18-19-33(38)27(4)20-30(35)22-32(33,6)7/h8-16,18-21,38H,17,22-23H2,1-7H3,(H,36,37)/b9-8+,14-10+,16-11+,19-18+,24-12+,25-13+,26-15+,29-21-/t33-/m0/s1

> <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(/COC(=O)C)=C/C(=O)O)C(C)=CC1=O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
162922967

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
66675

> <CITATION>
-

$$$$