In-Silico Structure database (LMISSD)
| |
LM ID | LMGP20029FNI |
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Common Name | PE(P-18:0/2:0) |
Systematic Name | 1-(1Z-octadecenyl)-2-acetyl-sn-glycero-3-phosphoethanolamine |
Synonyms | PE(P-20:0); PE(P-18:0/2:0) |
Exact Mass | |
Formula | C25H50NO7P |
Category | Glycerophospholipids [GP] |
Main Class | Oxidized glycerophospholipids [GP20] |
Sub Class | Oxidized glycerophosphoethanolamines [GP2002] |
PubChem Compound ID (CID) | - |
InChIKey | ZNPBWPVANORBHY-GYKXOELXSA-N |
InChI | InChI=1S/C25H50NO7P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-30-22-25(33-2 4(2)27)23-32-34(28,29)31-21-19-26/h18,20,25H,3-17,19,21-23,26H2,1-2H3,(H,28,29)/ b20-18-/t25-/m1/s1 |
SMILES | [C@](COP(=O)(O)OCCN)([H])(OC(C)=O)CO/C=C\CCCCCCCCCCCCCCCC |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |