In-Silico Structure database (LMISSD)
| |
LM ID | LMGP10029ABI |
---|---|
Common Name | PA(O-14:0/20:4(5E,8E,11E,14E)) |
Systematic Name | 1-tetradecyl-2-(5E,8E,11E,14E-eicosatetraenoyl)-sn-glycero-3-phosphate |
Synonyms | PA(O-34:4); PA(O-14:0/20:4) |
Exact Mass | |
Formula | C37H67O7P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphates [GP10] |
Sub Class | 1-alkyl,2-acylglycerophosphates [GP1002] |
PubChem Compound ID (CID) | - |
InChIKey | ZRUZTHSWNJXMOW-HSDNFEOZSA-N |
InChI | InChI=1S/C37H67O7P/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 0-21,24,26,36H,3-10,12,14-16,19,22-23,25,27-35H2,1-2H3,(H2,39,40,41)/b13-11+,18- 17+,21-20+,26-24+/t36-/m1/s1 |
SMILES | [C@](COP(=O)(O)O)([H])(OC(CCC/C=C/C/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) |