In-Silico Structure database (LMISSD)
| |
LM ID | LMGP02019BTS |
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Common Name | PE(18:2(2E,4E)/15:0) |
Systematic Name | 1-(2E,4E-octadecadienoyl)-2-pentadecanoyl-sn-glycero-3-phosphoethanolamine |
Synonyms | PE(33:2); PE(15:0_18:2) |
Exact Mass | |
Formula | C38H72NO8P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoethanolamines [GP02] |
Sub Class | Diacylglycerophosphoethanolamines [GP0201] |
PubChem Compound ID (CID) | - |
InChIKey | ZBSFPMINOYSATF-BGYRLJILSA-N |
InChI | InChI=1S/C38H72NO8P/c1-3-5-7-9-11-13-15-17-18-19-21-22-24-26-28-30-37(40)44-34-3 6(35-46-48(42,43)45-33-32-39)47-38(41)31-29-27-25-23-20-16-14-12-10-8-6-4-2/h24, 26,28,30,36H,3-23,25,27,29,31-35,39H2,1-2H3,(H,42,43)/b26-24+,30-28+/t36-/m1/s1 |
SMILES | [C@](COP(=O)(O)OCCN)([H])(OC(CCCCCCCCCCCCCC)=O)COC(/C=C/C=C/CCCCCCCCCCCCC)=O |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |