LMPR0106010044
  LIPID_MAPS_STRUCTURE_DATABASE

 30 29  0     0  0            999 V2000
   -0.4330   -0.2501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3054   -0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1782   -0.2501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0509   -0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9237   -0.2501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7965   -0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6693   -0.2501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5420   -0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4148   -0.2501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2876   -0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1603   -0.2501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.0331   -0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.9059   -0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.7786   -0.2501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.6514   -0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.5242   -0.2501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.3970   -0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.2697   -0.2501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.1425   -0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -17.0153   -0.2501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -17.8880   -0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -18.7608   -0.2501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -19.6336   -0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -20.5063   -0.2501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3053   -1.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7965   -1.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2876   -1.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -19.6336   -1.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.1425   -1.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.6514   -1.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 24  1  0  0  0  0
  2 25  1  0     0  0
  6 26  1  0     0  0
 10 27  1  0     0  0
 23 28  1  0     0  0
 19 29  1  0     0  0
 15 30  1  0     0  0
M  END
> <LM_ID>
LMPR0106010044

> <COMMON_NAME>
15-cis-4,4'-Diapophytoene

> <SYSTEMATIC_NAME>
(6E,10E,12Z,14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,12,14,18,22-heptaene

> <FORMULA>
C30H48

> <MASS>
408.38

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

> <SUB_CLASS>
C30 isoprenoids (triterpenes) [PR0106]

> <CLASS_LEVEL4>
Acyclic triterpenoids [PR010601]

> <SYNONYMS>
12-cis-dehydrosqualene

> <INCHI_KEY>
NXJJBCPAGHGVJC-LIKFLUFESA-N

> <INCHI>
InChI=1S/C30H48/c1-25(2)15-11-19-29(7)23-13-21-27(5)17-9-10-18-28(6)22-14-24-30(8)20-12-16-26(3)4/h9-10,15-18,23-24H,11-14,19-22H2,1-8H3/b10-9-,27-17+,28-18+,29-23+,30-24+

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

> <KEGG_ID>
C16144

> <HMDB_ID>
-

> <CHEBI_ID>
62738

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
14019219

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
1280

> <CITATION>
7275936

$$$$