In-Silico Structure database (LMISSD)
| |
LM ID | LMGP20029ACQ |
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Common Name | PE(11:0/2:0) |
Systematic Name | 1-undecanoyl-2-acetyl-sn-glycero-3-phosphoethanolamine |
Synonyms | PE(13:0); PE(11:0/2:0) |
Exact Mass | |
Formula | C18H36NO8P |
Category | Glycerophospholipids [GP] |
Main Class | Oxidized glycerophospholipids [GP20] |
Sub Class | Oxidized glycerophosphoethanolamines [GP2002] |
PubChem Compound ID (CID) | - |
InChIKey | ZLMKDOMQSPESAO-QGZVFWFLSA-N |
InChI | InChI=1S/C18H36NO8P/c1-3-4-5-6-7-8-9-10-11-18(21)24-14-17(27-16(2)20)15-26-28(22 ,23)25-13-12-19/h17H,3-15,19H2,1-2H3,(H,22,23)/t17-/m1/s1 |
SMILES | [C@](COP(=O)(O)OCCN)([H])(OC(C)=O)COC(CCCCCCCCCC)=O |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |