In-Silico Structure database (LMISSD)
| |
LM ID | LMGP20029ADJ |
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Common Name | PE(11:0/4:0) |
Systematic Name | 1-undecanoyl-2-butyryl-sn-glycero-3-phosphoethanolamine |
Synonyms | PE(15:0); PE(11:0/4:0) |
Exact Mass | |
Formula | C20H40NO8P |
Category | Glycerophospholipids [GP] |
Main Class | Oxidized glycerophospholipids [GP20] |
Sub Class | Oxidized glycerophosphoethanolamines [GP2002] |
PubChem Compound ID (CID) | - |
InChIKey | AXLLBMLWKDCAMG-GOSISDBHSA-N |
InChI | InChI=1S/C20H40NO8P/c1-3-5-6-7-8-9-10-11-13-19(22)26-16-18(29-20(23)12-4-2)17-28 -30(24,25)27-15-14-21/h18H,3-17,21H2,1-2H3,(H,24,25)/t18-/m1/s1 |
SMILES | [C@](COP(=O)(O)OCCN)([H])(OC(CCC)=O)COC(CCCCCCCCCC)=O |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |