In-Silico Structure database (LMISSD)
| |
LM ID | LMGP02019AU6 |
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Common Name | PE(16:1(7Z)/14:1(9Z)) |
Systematic Name | 1-(7Z-hexadecenoyl)-2-(9Z-tetradecenoyl)-sn-glycero-3-phosphoethanolamine |
Synonyms | PE(30:2); PE(14:1_16:1) |
Exact Mass | |
Formula | C35H66NO8P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoethanolamines [GP02] |
Sub Class | Diacylglycerophosphoethanolamines [GP0201] |
PubChem Compound ID (CID) | - |
InChIKey | WVQHERPPVIFEAU-PPHWIQGNSA-N |
InChI | InChI=1S/C35H66NO8P/c1-3-5-7-9-11-13-15-16-18-19-21-23-25-27-34(37)41-31-33(32-4 3-45(39,40)42-30-29-36)44-35(38)28-26-24-22-20-17-14-12-10-8-6-4-2/h10,12,16,18, 33H,3-9,11,13-15,17,19-32,36H2,1-2H3,(H,39,40)/b12-10-,18-16-/t33-/m1/s1 |
SMILES | [C@](COP(=O)(O)OCCN)([H])(OC(CCCCCCC/C=C\CCCC)=O)COC(CCCCC/C=C\CCCCCCCC)=O |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |