In-Silico Structure database (LMISSD)
| |
LM ID | LMGP02029AQL |
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Common Name | PE(O-18:1(9Z)/15:0) |
Systematic Name | 1-(9Z-octadecenyl)-2-pentadecanoyl-sn-glycero-3-phosphoethanolamine |
Synonyms | PE(O-33:1); PE(O-18:1/15:0) |
Exact Mass | |
Formula | C38H76NO7P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoethanolamines [GP02] |
Sub Class | 1-alkyl,2-acylglycerophosphoethanolamines [GP0202] |
PubChem Compound ID (CID) | - |
InChIKey | WZJCRNQFLSVBEZ-OTMQOFQLSA-N |
InChI | InChI=1S/C38H76NO7P/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-33-43-35-37(3 6-45-47(41,42)44-34-32-39)46-38(40)31-29-27-25-23-21-16-14-12-10-8-6-4-2/h17-18, 37H,3-16,19-36,39H2,1-2H3,(H,41,42)/b18-17-/t37-/m1/s1 |
SMILES | [C@](COP(=O)(O)OCCN)([H])(OC(CCCCCCCCCCCCCC)=O)COCCCCCCCC/C=C\CCCCCCCC |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |