In-Silico Structure database (LMISSD)
| |
LM ID | LMGP02039DDK |
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Common Name | PE(P-14:0/14:1(9Z)) |
Systematic Name | 1-(1Z-tetradecenyl)-2-(9Z-tetradecenoyl)-sn-glycero-3-phosphoethanolamine |
Synonyms | PE(P-28:1); PE(P-14:0/14:1) |
Exact Mass | |
Formula | C33H64NO7P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoethanolamines [GP02] |
Sub Class | 1-(1Z-alkenyl),2-acylglycerophosphoethanolamines [GP0203] |
PubChem Compound ID (CID) | - |
InChIKey | RJBZWQGRBKMFAF-NLEKZIACSA-N |
InChI | InChI=1S/C33H64NO7P/c1-3-5-7-9-11-13-15-17-19-21-23-25-28-38-30-32(31-40-42(36,3 7)39-29-27-34)41-33(35)26-24-22-20-18-16-14-12-10-8-6-4-2/h10,12,25,28,32H,3-9,1 1,13-24,26-27,29-31,34H2,1-2H3,(H,36,37)/b12-10-,28-25-/t32-/m1/s1 |
SMILES | [C@](COP(=O)(O)OCCN)([H])(OC(CCCCCCC/C=C\CCCC)=O)CO/C=C\CCCCCCCCCCCC |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |