LMFA01031255
  LIPID_MAPS_STRUCTURE_DATABASE

 34 33  0     0  0            999 V2000
   -0.4342   -0.2508    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4342   -0.7521    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4342    0.7521    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3091   -0.7521    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1843   -1.2535    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0595   -1.7549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9347   -1.7549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8099   -1.2536    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6851   -1.7549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5604   -1.2536    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4356   -1.7549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3108   -1.2536    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1860   -1.7549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.0612   -1.2536    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.9364   -1.7549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.8116   -1.2536    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.6869   -1.7549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.5621   -1.2536    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.4373   -1.2536    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.3125   -1.7549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.1877   -1.2536    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -17.0629   -1.7549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -17.9382   -1.2536    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -18.8134   -1.7549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -19.6886   -1.2536    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -20.5638   -1.7549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -21.4390   -1.2536    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -22.3142   -1.7549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -23.1895   -1.2536    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -24.0647   -1.7549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -24.9399   -1.2536    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -25.8151   -1.7549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -26.6903   -2.2564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -24.9399   -0.2508    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  4  5  3  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  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  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  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  2  0  0  0  0
 30 31  1  0  0  0  0
 31 32  1  0  0  0  0
 32 33  3  0  0  0  0
 31 34  1  6  0  0  0
M  END
> <LM_ID>
LMFA01031255

> <COMMON_NAME>
(-)-Petrosynoic acid A

> <SYSTEMATIC_NAME>
9R-Hydroxyhentriaconta-4Z,16Z,27E-trien-2,30-diynoic acid

> <FORMULA>
C31H48O3

> <MASS>
468.36

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Unsaturated fatty acids [FA0103]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
GQTINRSAAWYFKQ-PJJOJYBGSA-N

> <INCHI>
InChI=1S/C31H48O3/c1-2-30(32)28-26-24-22-20-18-16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31(33)34/h1,4,6,23,25-26,28,30,32H,3,5,7-22,24H2,(H,33,34)/b6-4-,25-23-,28-26+/t30-/m0/s1

> <SMILES>
C(C#C/C=C\CCCCCCCCCC/C=C\CCCCCCCCC/C=C/[C@@H](O)C#C)(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FA 31:7;O

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
71658902

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Fatty Acids and Conjugates [FA01]

> <ALT_SUB_CLASSES>
Hydroxy fatty acids [FA0105]

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
68563

> <CITATION>
23368996

$$$$