In-Silico Structure database (LMISSD)
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LM ID | LMGP05019ADZ |
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Common Name | PGP(11:0/20:5(5Z,8Z,11Z,14Z,17Z)) |
Systematic Name | 1-undecanoyl-2-(5Z,8Z,11Z,14Z,17Z-eicosapentaenoyl)-sn-glycero-3-phospho-(1'- sn-glycerol-3'-phosphate) |
Synonyms | PGP(31:5); PGP(11:0_20:5) |
Exact Mass | |
Formula | C37H64O13P2 |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoglycerophosphates [GP05] |
Sub Class | Diacylglycerophosphoglycerophosphates [GP0501] |
PubChem Compound ID (CID) | - |
InChIKey | HKDDACPFGYDMEL-IJFGPUFLSA-N |
InChI | InChI=1S/C37H64O13P2/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-21-23-25-27-29-37(40) 50-35(32-46-36(39)28-26-24-22-12-10-8-6-4-2)33-49-52(44,45)48-31-34(38)30-47-51( 41,42)43/h5,7,11,13,15-16,18-19,21,23,34-35,38H,3-4,6,8-10,12,14,17,20,22,24-33H 2,1-2H3,(H,44,45)(H2,41,42,43)/b7-5-,13-11-,16-15-,19-18-,23-21-/t34-,35+/m0/s1 |
SMILES | [H][C@](O)(COP(O)(O)=O)COP(OC[C@]([H])(OC(CCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)=O) COC(CCCCCCCCCC)=O)(=O)O |
MS Spectra | - |
Status | Active (generated by computational methods) |