In-Silico Structure database (LMISSD)
| |
LM ID | LMGP02039ALX |
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Common Name | PE(P-18:1(9Z)/14:0) |
Systematic Name | 1-(1Z,9Z-octadecadienyl)-2-tetradecanoyl-sn-glycero-3-phosphoethanolamine |
Synonyms | PE(P-32:1); PE(P-18:1/14:0) |
Exact Mass | |
Formula | C37H72NO7P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoethanolamines [GP02] |
Sub Class | 1-(1Z-alkenyl),2-acylglycerophosphoethanolamines [GP0203] |
PubChem Compound ID (CID) | - |
InChIKey | IOHZRULUOZSNIU-BOYFLGGYSA-N |
InChI | InChI=1S/C37H72NO7P/c1-3-5-7-9-11-13-15-16-17-18-19-21-23-25-27-29-32-42-34-36(3 5-44-46(40,41)43-33-31-38)45-37(39)30-28-26-24-22-20-14-12-10-8-6-4-2/h16-17,29, 32,36H,3-15,18-28,30-31,33-35,38H2,1-2H3,(H,40,41)/b17-16-,32-29-/t36-/m1/s1 |
SMILES | [C@](COP(=O)(O)OCCN)([H])(OC(CCCCCCCCCCCCC)=O)CO/C=C\CCCCCC/C=C\CCCCCCCC |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |