PGM

1-MYRISTOYL-2-HYDROXY-SN-GLYCERO-3-[PHOSPHO-RAC-(1-GLYCEROL)]

Created:2002-12-12
Last modified:  2021-03-01

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Chemical Details

Formal Charge-1
Atom Count76
Chiral Atom Count2
Bond Count75
Aromatic Bond Count0
2D diagram of PGM

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Chemical Component Summary

Name1-MYRISTOYL-2-HYDROXY-SN-GLYCERO-3-[PHOSPHO-RAC-(1-GLYCEROL)]
SynonymsLYSOPHOSPHATIDYLGLYCEROL
Systematic Name (OpenEye OEToolkits)[(2S)-2,3-dihydroxypropyl] [(2S)-3-hexadecanoyloxy-2-hydroxy-propyl] phosphate
FormulaC22 H44 O9 P
Molecular Weight483.553
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C(OCC(O)COP([O-])(=O)OCC(O)CO)CCCCCCCCCCCCCCC
SMILESCACTVS3.385CCCCCCCCCCCCCCCC(=O)OC[CH](O)CO[P]([O-])(=O)OC[CH](O)CO
SMILESOpenEye OEToolkits1.7.5CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC(CO)O)O
Canonical SMILESCACTVS3.385 CCCCCCCCCCCCCCCC(=O)OC[C@H](O)CO[P]([O-])(=O)OC[C@@H](O)CO
Canonical SMILESOpenEye OEToolkits1.7.5 CCCCCCCCCCCCCCCC(=O)OC[C@@H](COP(=O)([O-])OC[C@H](CO)O)O
InChIInChI1.03 InChI=1S/C22H45O9P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-22(26)29-17-21(25)19-31-32(27,28)30-18-20(24)16-23/h20-21,23-25H,2-19H2,1H3,(H,27,28)/p-1/t20-,21-/m0/s1
InChIKeyInChI1.03 BVJSKAUUFXBDOB-SFTDATJTSA-M

Drug Info: DrugBank

DrugBank data are sourced from datasets licensed under a Creative Common's Attribution-NonCommercial 4.0 International License
DrugBank IDDB03438 
NameLysophosphatidylglycerol
Groups experimental
SynonymsLysophosphatidylglycerol
Categories
  • Glycerophosphates
  • Lipids
  • Membrane Lipids
  • Phosphatidic Acids
  • Phospholipids

Related Resource References

Resource NameReference
PubChem 5289143