LHG

1,2-DIPALMITOYL-PHOSPHATIDYL-GLYCEROLE

Created: 2001-06-25
Last modified:  2011-06-04

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Chemical Details

Formal Charge0
Atom Count124
Chiral Atom Count3
Bond Count123
Aromatic Bond Count0
2D diagram of LHG

Chemical Component Summary

Name1,2-DIPALMITOYL-PHOSPHATIDYL-GLYCEROLE
Systematic Name (OpenEye OEToolkits)[(2R)-3-[[(2S)-2,3-dihydroxypropoxy]-hydroxy-phosphoryl]oxy-2-hexadecanoyloxy-propyl] hexadecanoate
FormulaC38 H75 O10 P
Molecular Weight722.97
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs10.04O=C(OC(COP(=O)(OCC(O)CO)O)COC(=O)CCCCCCCCCCCCCCC)CCCCCCCCCCCCCCC
SMILESCACTVS3.341CCCCCCCCCCCCCCCC(=O)OC[CH](CO[P](O)(=O)OC[CH](O)CO)OC(=O)CCCCCCCCCCCCCCC
SMILESOpenEye OEToolkits1.5.0CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCC(CO)O)OC(=O)CCCCCCCCCCCCCCC
Canonical SMILESCACTVS3.341 CCCCCCCCCCCCCCCC(=O)OC[C@H](CO[P@](O)(=O)OC[C@@H](O)CO)OC(=O)CCCCCCCCCCCCCCC
Canonical SMILESOpenEye OEToolkits1.5.0 CCCCCCCCCCCCCCCC(=O)OC[C@H](CO[P@@](=O)(O)OC[C@H](CO)O)OC(=O)CCCCCCCCCCCCCCC
InChIInChI1.03 InChI=1S/C38H75O10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-37(41)45-33-36(34-47-49(43,44)46-32-35(40)31-39)48-38(42)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h35-36,39-40H,3-34H2,1-2H3,(H,43,44)/t35-,36+/m0/s1
InChIKeyInChI1.03 BIABMEZBCHDPBV-MPQUPPDSSA-N

Drug Info: DrugBank

DrugBank IDDB02043 
Name1,2-Dipalmitoyl-Phosphatidyl-Glycerole
Groups experimental
Synonyms1,2-Dipalmitoyl-Phosphatidyl-Glycerole

Drug Targets

NameTarget SequencePharmacological ActionActions
V-type sodium ATPase subunit KMMDYLITQNGGMVFAVLAMATATIFSGIGSAKGVGMTGEAAAALTTSQPE...unknown
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682

Related Resource References

Resource NameReference
PubChem 446440
ChEBI CHEBI:73205