LMFA12000365
  LIPID_MAPS_STRUCTURE_DATABASE

 11 11  0     0  0            999 V2000
   -1.8719    0.8357    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3781   -0.0118    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8746   -0.8475    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8648   -0.8357    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3586    0.0118    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8621    0.8475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6524    0.0118    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6633    0.0118    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6742    0.0118    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3890    0.7266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3890   -0.0118    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0     0  0
  2  3  1  0     0  0
  4  5  1  0     0  0
  5  6  2  0     0  0
  6  1  1  0     0  0
  5  7  1  0     0  0
  3  4  1  0     0  0
  7  8  3  0     0  0
  8  9  1  0     0  0
  9 10  2  0     0  0
  2 11  1  0     0  0
M  END
> <LM_ID>
LMFA12000365

> <COMMON_NAME>
3-(but-3-en-1-yn-1-yl)-6-methyl-1,2-dithiine

> <SYSTEMATIC_NAME>
3-(but-3-en-1-yn-1-yl)-6-methyl-1,2-dithiine

> <FORMULA>
C9H8S2

> <MASS>
180.01

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Oxygenated hydrocarbons [FA12]

> <SUB_CLASS>


> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
SEXDKVHSFVCQMZ-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C9H8S2/c1-3-4-5-9-7-6-8(2)10-11-9/h3,6-7H,1H2,2H3

> <SMILES>
C1C=C(C#CC=C)SSC=1C

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
134812260

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$