LMPR01070506
  LIPID_MAPS_STRUCTURE_DATABASE

 40 40  0     0  0            999 V2000
    2.1740  -10.6961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1740  -11.6954    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0395  -12.1951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9050  -11.6954    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9050  -10.6961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0395  -10.1964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7883  -10.1964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6538  -10.6961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5191  -10.1964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3846  -10.6961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2501  -10.1964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1153  -10.6961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9808  -10.1964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8463  -10.6961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7117  -10.1964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5771  -10.6961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4425  -10.1964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3079  -10.6961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1734  -10.1964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0388  -10.6961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9041  -10.1964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.7696  -10.6961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.6349  -10.1964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.5004  -10.6961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.3658  -10.1964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.2313  -10.6961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.0967  -10.1964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.9621  -10.6961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.8275  -10.1964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.6931  -10.6961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5191   -9.1971    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9808   -9.1971    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3079  -11.6954    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.7696  -11.6954    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.2313  -11.6954    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.5697  -10.1897    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.6932  -11.7028    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0394   -9.2082    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4053  -12.5619    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9056  -11.6954    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  2  0     0  0
  5  7  2  0     0  0
  7  8  1  0     0  0
  8  9  2  0     0  0
  9 10  1  0     0  0
 10 11  2  0     0  0
 11 12  1  0     0  0
 12 13  2  0     0  0
 13 14  1  0     0  0
 14 15  2  0     0  0
 15 16  1  0     0  0
 16 17  2  0     0  0
 17 18  1  0     0  0
 18 19  2  0     0  0
 19 20  1  0     0  0
 20 21  2  0     0  0
 21 22  1  0     0  0
 22 23  2  0     0  0
 23 24  1  0     0  0
 24 25  2  0     0  0
 25 26  1  0     0  0
 26 27  2  0     0  0
 27 28  1  0     0  0
 28 29  1  0     0  0
 29 30  2  0     0  0
  9 31  1  0     0  0
 13 32  1  0     0  0
 18 33  1  0     0  0
 22 34  1  0     0  0
 26 35  1  0     0  0
 30 36  1  0     0  0
 30 37  1  0     0  0
  6 38  1  0     0  0
  4 39  1  0     0  0
  4 40  1  0     0  0
M  END
> <LM_ID>
LMPR01070506

> <COMMON_NAME>
Retrodehydro-gamma-carotene

> <SYSTEMATIC_NAME>
4',5'-Didehydro-4,5'-retro-beta,psi-carotene

> <FORMULA>
C40H54

> <MASS>
534.42

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

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

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
UTAFUWBLXSBGIT-OSZCQGCRSA-N

> <INCHI>
InChI=1S/C40H54/c1-32(2)18-13-21-35(5)24-15-26-36(6)25-14-22-33(3)19-11-12-20-34(4)23-16-27-37(7)29-30-39-38(8)28-17-31-40(39,9)10/h11-12,14-16,18-30H,13,17,31H2,1-10H3/b19-11+,20-12+,24-15+,25-14+,27-16+,33-22+,34-23+,35-21+,36-26+,37-29+,39-30-

> <SMILES>
C1=C(C)/C(=C/C=C(\C)/C=C/C=C(\C)/C=C/C=C/C(/C)=C/C=C/C(/C)=C/C=C/C(/C)=C/C/C=C(\C)/C)/C(C)(C)CC1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
171121055

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
84086

> <CITATION>
-

$$$$