LMPR01070129
  LIPID_MAPS_STRUCTURE_DATABASE

 40 39  0     0  0            999 V2000
    9.3152    8.2281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2123    7.7281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0424    8.2281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0424    9.2284    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5948    9.1683    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5948    8.2281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4484    7.7281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9361    7.7281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7830    8.2281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6831    7.7281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5267    8.2281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5267    9.2284    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   33.6391    8.2281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   32.7688    7.7281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3970    7.7281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2540    8.2281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.5604    7.7281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.6936    8.2281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1409    7.7281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.0046    8.2281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.0046    9.2284    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.8781    7.7281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.7451    8.2281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.5886    7.7281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.4655    8.2281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.3492    7.7281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.2161    8.2281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.3492    6.7278    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.0862    7.7281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.8234    7.7281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.8234    6.7278    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.9400    8.2281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.3212    6.7278    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.3212    7.7281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   28.4711    8.2281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   31.0585    7.7281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   30.1447    8.2281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   32.7688    6.7278    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   31.9019    8.2281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7278    7.7281    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  2  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  1  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  2  0  0  0  0
 16 19  1  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
M  END
> <LM_ID>
LMPR01070129

> <COMMON_NAME>
Asymmetrical zeta-carotene

> <SYSTEMATIC_NAME>
7,8,11,12-Tetrahydro-psi,psi-carotene

> <FORMULA>
C40H60

> <MASS>
540.47

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

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

> <CLASS_LEVEL4>
-

> <SYNONYMS>
Asym. zeta-carotene; 7,8,11,12-Tetrahydrolycopene

> <INCHI_KEY>
YTZIWAULTIDEEY-JLGWONFISA-N

> <INCHI>
InChI=1S/C40H60/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,15,17,19-22,25,27-31H,13-14,16,18,23-24,26,32H2,1-10H3/b12-11+,25-15+,31-17+,35-21+,36-22+,37-27+,38-28+,39-29+,40-30+

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
16061252

> <LIPIDBANK_ID>
VCA1047

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
1085

> <CITATION>
-

$$$$