In-Silico Structure database (LMISSD)
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LM ID | LMGP04019DHL |
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Common Name | PG(20:5(5Z,8Z,11Z,14Z,17Z)/11:0) |
Systematic Name | 1-(5Z,8Z,11Z,14Z,17Z-eicosapentaenoyl)-2-undecanoyl-sn-glycero-3-phospho-(1'- sn-glycerol) |
Synonyms | PG(31:5); PG(11:0_20:5) |
Exact Mass | |
Formula | C37H63O10P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoglycerols [GP04] |
Sub Class | Diacylglycerophosphoglycerols [GP0401] |
PubChem Compound ID (CID) | - |
InChIKey | IMLILDGIJVEQHL-IJFGPUFLSA-N |
InChI | InChI=1S/C37H63O10P/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-21-23-24-26-28-36(40)4 4-32-35(33-46-48(42,43)45-31-34(39)30-38)47-37(41)29-27-25-22-12-10-8-6-4-2/h5,7 ,11,13,15-16,18-19,21,23,34-35,38-39H,3-4,6,8-10,12,14,17,20,22,24-33H2,1-2H3,(H ,42,43)/b7-5-,13-11-,16-15-,19-18-,23-21-/t34-,35+/m0/s1 |
SMILES | [H][C@](O)(CO)COP(OC[C@]([H])(OC(CCCCCCCCCC)=O)COC(CCC/C=C\C/C=C\C/C=C\C/C=C\C/C =C\CC)=O)(=O)O |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |