LMGP03050026
  LIPID_MAPS_STRUCTURE_DATABASE

 40 39  0  0  0  0  0  0  0  0999 V2000
   24.4429    6.4013    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.7934    5.8592    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.1544    6.2269    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.5153    5.8592    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.8763    6.2269    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.8763    6.9655    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.1628    5.2201    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   19.4240    5.2201    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.2373    5.8592    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.4326    6.2281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.0717    5.8592    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   22.6538    5.8438    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.2929    5.4747    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.9321    5.8438    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.5712    5.4747    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   21.9811    6.1177    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   21.6555    5.5533    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.9811    6.7905    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.6295    6.3679    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   24.4429    7.0559    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   25.0000    6.0797    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.5933    6.2281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9492    5.8592    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3051    6.2281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6611    5.8592    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0170    6.2281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3729    5.8592    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7288    6.2281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0848    5.8592    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4407    6.2281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7966    5.8592    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1526    6.2281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5085    5.8592    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8644    6.2281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2204    5.8592    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5763    6.2281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9322    5.8592    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2881    6.2281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6441    5.8592    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.2281    0.0000 C   0  0  0  0  0  0  0  0  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  6  2  0  0  0  0
  5  9  1  0  0  0  0
  2  8  1  6  0  0  0
  2  7  1  1  0  0  0
 10  2  1  0  0  0  0
 11 10  1  0  0  0  0
 13 12  1  0  0  0  0
 14 13  1  0  0  0  0
 15 14  1  0  0  0  0
 16 12  1  0  0  0  0
 16 17  1  0  0  0  0
 16 18  2  0  0  0  0
 16 11  1  0  0  0  0
 14 19  1  6  0  0  0
 14  1  1  1  0  0  0
  1 20  2  0  0  0  0
  1 21  1  0  0  0  0
  9 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  1  0  0  0  0
 30 31  1  0  0  0  0
 31 32  1  0  0  0  0
 32 33  1  0  0  0  0
 33 34  1  0  0  0  0
 34 35  1  0  0  0  0
 35 36  1  0  0  0  0
 36 37  1  0  0  0  0
 37 38  1  0  0  0  0
 38 39  1  0  0  0  0
 39 40  1  0  0  0  0
M  END
> <LM_ID>
LMGP03050026

> <COMMON_NAME>
PS 21:0/0:0

> <SYSTEMATIC_NAME>
1-heneicosanoyl-glycero-3-phosphoserine

> <FORMULA>
C27H54NO9P

> <MASS>
567.35

> <CATEGORY>
Glycerophospholipids [GP]

> <MAIN_CLASS>
Glycerophosphoserines [GP03]

> <SUB_CLASS>
Monoacylglycerophosphoserines [GP0305]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
LPS(21:0)

> <INCHI_KEY>
IFZCAKDVWKLKEK-RPBOFIJWSA-N

> <INCHI>
InChI=1S/C27H54NO9P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26(30)35-21-24(29)22-36-38(33,34)37-23-25(28)27(31)32/h24-25,29H,2-23,28H2,1H3,(H,31,32)(H,33,34)/t24-,25+/m1/s1

> <SMILES>
C(O)(=O)[C@@]([H])(N)COP(OC[C@]([H])(O)COC(CCCCCCCCCCCCCCCCCCCC)=O)(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
187993

> <ABBREVIATION>
LPS 21:0

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
SLM:000030096

> <PUBCHEM_COMPOUND_ID>
52926294

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$