In-Silico Structure database (LMISSD)
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LM ID | LMGP10029ABH |
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Common Name | PA(O-14:0/20:3(8Z,11Z,14Z)) |
Systematic Name | 1-tetradecyl-2-(8Z,11Z,14Z-eicosatrienoyl)-sn-glycero-3-phosphate |
Synonyms | PA(O-34:3); PA(O-14:0/20:3) |
Exact Mass | |
Formula | C37H69O7P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphates [GP10] |
Sub Class | 1-alkyl,2-acylglycerophosphates [GP1002] |
PubChem Compound ID (CID) | - |
InChIKey | MPQBMILPGDCBKQ-ILXKRTFMSA-N |
InChI | InChI=1S/C37H69O7P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-37(38)44 -36(35-43-45(39,40)41)34-42-33-31-29-27-25-23-16-14-12-10-8-6-4-2/h11,13,17-18,2 0-21,36H,3-10,12,14-16,19,22-35H2,1-2H3,(H2,39,40,41)/b13-11-,18-17-,21-20-/t36- /m1/s1 |
SMILES | [C@](COP(=O)(O)O)([H])(OC(CCCCCC/C=C\C/C=C\C/C=C\CCCCC)=O)COCCCCCCCCCCCCCC |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |