In-Silico Structure database (LMISSD)
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LM ID | LMGP02019AKF |
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Common Name | PE(14:0/18:4(9E,11E,13E,15E)) |
Systematic Name | 1-tetradecanoyl-2-(9E,11E,13E,15E-octadecatetraenoyl)-sn-glycero-3- phosphoethanolamine |
Synonyms | PE(32:4); PE(14:0_18:4) |
Exact Mass | |
Formula | C37H66NO8P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoethanolamines [GP02] |
Sub Class | Diacylglycerophosphoethanolamines [GP0201] |
PubChem Compound ID (CID) | - |
InChIKey | XXDSTKWGPFANAA-FIDVBWPWSA-N |
InChI | InChI=1S/C37H66NO8P/c1-3-5-7-9-11-13-15-16-17-18-20-22-24-26-28-30-37(40)46-35(3 4-45-47(41,42)44-32-31-38)33-43-36(39)29-27-25-23-21-19-14-12-10-8-6-4-2/h5,7,9, 11,13,15-17,35H,3-4,6,8,10,12,14,18-34,38H2,1-2H3,(H,41,42)/b7-5+,11-9+,15-13+,1 7-16+/t35-/m1/s1 |
SMILES | [C@](COP(=O)(O)OCCN)([H])(OC(CCCCCCC/C=C/C=C/C=C/C=C/CC)=O)COC(CCCCCCCCCCCCC)=O |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |