In-Silico Structure database (LMISSD)
| |
LM ID | LMGP10029ABC |
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Common Name | PA(O-14:0/20:1(13E)) |
Systematic Name | 1-tetradecyl-2-(13E-eicosenoyl)-sn-glycero-3-phosphate |
Synonyms | PA(O-34:1); PA(O-14:0/20:1) |
Exact Mass | |
Formula | C37H73O7P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphates [GP10] |
Sub Class | 1-alkyl,2-acylglycerophosphates [GP1002] |
PubChem Compound ID (CID) | - |
InChIKey | PEEXEQQEVUBWGW-ASZZUVEKSA-N |
InChI | InChI=1S/C37H73O7P/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/h13,15,36H,3-1 2,14,16-35H2,1-2H3,(H2,39,40,41)/b15-13+/t36-/m1/s1 |
SMILES | [C@](COP(=O)(O)O)([H])(OC(CCCCCCCCCCC/C=C/CCCCCC)=O)COCCCCCCCCCCCCCC |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |