LMGP06050017
LIPID_MAPS_STRUCTURE_DATABASE

 41 41  0  0  0  0  0  0  0  0999 V2000
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   -1.3689    0.4069    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8169    0.3829    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1127    0.7262    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.1127    1.5699    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7417    2.5022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6737    1.9641    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.7417   -0.7265    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    4.6057    2.5022    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  4  8  1  0  0  0  0
  9  1  1  0  0  0  0
 10  9  1  0  0  0  0
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  1  7  1  6  0  0  0
  1  6  1  1  0  0  0
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M  END
> <LM_ID>
LMGP06050017

> <COMMON_NAME>
PI 18:4(6Z,9Z,12Z,15Z)/0:0

> <SYSTEMATIC_NAME>
1-(6Z,9Z,12Z,15Z-octadecatetraenoyl)-glycero-3-phospho-(1'-myo-inositol)

> <FORMULA>
C27H45O12P

> <MASS>
592.26

> <CATEGORY>
Glycerophospholipids [GP]

> <MAIN_CLASS>
Glycerophosphoinositols [GP06]

> <SUB_CLASS>
Monoacylglycerophosphoinositols [GP0605]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
LPI(18:4)

> <INCHI_KEY>
RZLNVOWKGBDTLF-LQZFJLJHSA-N

> <INCHI>
InChI=1S/C27H45O12P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(29)37-18-20(28)19-38-40(35,36)39-27-25(33)23(31)22(30)24(32)26(27)34/h3-4,6-7,9-10,12-13,20,22-28,30-34H,2,5,8,11,14-19H2,1H3,(H,35,36)/b4-3-,7-6-,10-9-,13-12-/t20-,22-,23-,24+,25-,26-,27-/m1/s1

> <SMILES>
[C@]([H])(O)(COP(=O)(O)O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O)COC(CCCC/C=C\C/C=C\C/C=C\C/C=C\CC)=O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
LPI 18:4

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
SLM:000043009

> <PUBCHEM_COMPOUND_ID>
52928612

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$