In-Silico Structure database (LMISSD)
| |
LM ID | LMGP20029ABL |
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Common Name | PE(10:0/4:0(4Ke)) |
Systematic Name | 1-decanoyl-2-(4-oxobutyryl)-sn-glycero-3-phosphoethanolamine |
Synonyms | PE(14:0(Ke)); PE(10:0/4:0(Ke)) |
Exact Mass | |
Formula | C19H36NO9P |
Category | Glycerophospholipids [GP] |
Main Class | Oxidized glycerophospholipids [GP20] |
Sub Class | Oxidized glycerophosphoethanolamines [GP2002] |
PubChem Compound ID (CID) | - |
InChIKey | DCQCMNNRIQFIEW-QGZVFWFLSA-N |
InChI | InChI=1S/C19H36NO9P/c1-2-3-4-5-6-7-8-10-18(22)26-15-17(29-19(23)11-9-13-21)16-28 -30(24,25)27-14-12-20/h13,17H,2-12,14-16,20H2,1H3,(H,24,25)/t17-/m1/s1 |
SMILES | [C@](COP(=O)(O)OCCN)([H])(OC(CCC=O)=O)COC(CCCCCCCCC)=O |
MS Spectra | - |
Status | Active (generated by computational methods) |