LMFA03010114
  LIPID_MAPS_STRUCTURE_DATABASE

 26 26  0     0  0            999 V2000
    7.9927    7.6484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9927    8.6484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0416    8.9575    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4538    8.1484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0416    7.3394    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8017    9.2363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6677    8.7363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8017    7.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6677    7.5606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5338    7.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3998    7.5606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2658    7.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1319    7.5606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9978    7.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8639    7.5606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    9.9085    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.5338    6.0606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6677    8.7363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5338    9.2363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3998    8.7363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2658    9.2363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1319    8.7363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9978    9.2363    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    6.3884    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.9978   10.2361    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8639    8.7363    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
  4  5  1  0  0  0  0
  5  1  1  0  0  0  0
  2  6  1  6  0  0  0
  6  7  1  0  0  0  0
  1  8  1  1  0  0  0
  8  9  2  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
  3 16  1  6  0  0  0
 10 17  1  6  0  0  0
  7 18  2  0  0  0  0
 19 18  1  0  0  0  0
 20 19  1  0  0  0  0
 21 20  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
  5 24  1  6  0  0  0
 23 25  1  0  0  0  0
 23 26  1  0  0  0  0
M  END
> <LM_ID>
LMFA03010114

> <COMMON_NAME>
PGE2alpha dimethyl amine

> <SYSTEMATIC_NAME>
1-dimethylamino-9S,11R,15S-trihydroxy-5Z,13E-prostadiene

> <FORMULA>
C22H41NO3

> <MASS>
367.31

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Eicosanoids [FA03]

> <SUB_CLASS>
Prostaglandins [FA0301]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
Prostaglandin E2alpha dimethyl amine

> <INCHI_KEY>
VNLQPSLXSAMMMJ-PIOKUXGXSA-N

> <INCHI>
InChI=1S/C22H41NO3/c1-4-5-9-12-18(24)14-15-20-19(21(25)17-22(20)26)13-10-7-6-8-11-16-23(2)3/h7,10,14-15,18-22,24-26H,4-6,8-9,11-13,16-17H2,1-3H3/b10-7-,15-14+/t18-,19+,20+,21-,22+/m0/s1

> <SMILES>
[C@H]1(/C=C/[C@@H](O)CCCCC)[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCCN(C)C

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
73741

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5283101

> <LIPIDBANK_ID>
XPR1784

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
32630

> <CITATION>
661964

$$$$