LMPR01070869
  LIPID_MAPS_STRUCTURE_DATABASE

 43 44  0     0  0            999 V2000
    4.6077   -9.2009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4724   -8.7017    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3371   -9.2009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2017   -8.7017    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0663   -9.2009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9310   -8.7017    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7956   -9.2009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6602   -8.7017    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5249   -9.2009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3895   -8.7017    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2542   -9.2009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1188   -8.7017    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9834   -9.2009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8481   -8.7017    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7127   -9.2009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.5774   -8.7017    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.4420   -9.2009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3067   -8.7017    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.1713   -9.2009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.0360   -8.7017    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2017   -7.7033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6602   -7.7034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.4420  -10.1993    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9834  -10.1993    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6956   -8.7948    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0276   -9.5368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5268  -10.4014    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5034  -10.1938    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9897   -8.0888    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9541   -7.8304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0191   -9.4306    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1189  -11.3178    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.2506  -10.8666    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.9221   -9.2134    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.7877   -8.7137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.7878   -7.7142    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.9017   -7.2025    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.0361   -7.7022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.1911   -7.2142    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.9018   -6.2129    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.6685   -7.2057    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.4224  -10.0789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.4218  -10.0789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  2  3  2  0     0  0
  3  4  1  0     0  0
  4  5  2  0     0  0
  5  6  1  0     0  0
  6  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
  4 21  1  0     0  0
  8 22  1  0     0  0
 17 23  1  0     0  0
 13 24  1  0     0  0
  1 25  1  0     0  0
 25 26  1  0     0  0
 26 27  1  0     0  0
 27 28  1  0     0  0
  1 28  2  0     0  0
 25 29  1  0     0  0
 25 30  1  0     0  0
 26 31  1  0     0  0
 27 32  2  0     0  0
 28 33  1  0     0  0
 20 34  1  0     0  0
 34 35  1  0     0  0
 35 36  1  0     0  0
 36 37  1  0     0  0
 37 38  1  0     0  0
 20 38  2  0     0  0
 38 39  1  0     0  0
 37 40  2  0     0  0
 36 41  1  0     0  0
 34 42  1  0     0  0
 34 43  1  0     0  0
M  END
> <LM_ID>
LMPR01070869

> <COMMON_NAME>
2-Norastaxanthin

> <SYSTEMATIC_NAME>
3,3'-Dihydroxy-2-nor-beta,beta-carotene-4,4'-dione

> <FORMULA>
C39H50O4

> <MASS>
582.37

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

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

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
FAUPTMPFUUOOQV-PONOSZKISA-N

> <INCHI>
InChI=1S/C39H50O4/c1-26(17-13-19-28(3)21-23-32-30(5)35(41)34(40)25-38(32,7)8)15-11-12-16-27(2)18-14-20-29(4)22-24-33-31(6)36(42)37(43)39(33,9)10/h11-24,34,37,40,43H,25H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,26-15+,27-16+,28-19+,29-20+

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
171118930

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
6106

> <CITATION>
-

$$$$