In-Silico Structure database (LMISSD)
| |
LM ID | LMGP20029ABS |
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Common Name | PE(10:0/6:1(4E)(6Ke)) |
Systematic Name | 1-decanoyl-2-(6-oxo-4E-hexenoyl)-sn-glycero-3-phosphoethanolamine |
Synonyms | PE(16:1(Ke)); PE(10:0/6:1(Ke)) |
Exact Mass | |
Formula | C21H38NO9P |
Category | Glycerophospholipids [GP] |
Main Class | Oxidized glycerophospholipids [GP20] |
Sub Class | Oxidized glycerophosphoethanolamines [GP2002] |
PubChem Compound ID (CID) | - |
InChIKey | SAGVVDYZWGRHFK-UFUQCMIWSA-N |
InChI | InChI=1S/C21H38NO9P/c1-2-3-4-5-6-7-9-12-20(24)28-17-19(18-30-32(26,27)29-16-14-2 2)31-21(25)13-10-8-11-15-23/h8,11,15,19H,2-7,9-10,12-14,16-18,22H2,1H3,(H,26,27) /b11-8+/t19-/m1/s1 |
SMILES | [C@](COP(=O)(O)OCCN)([H])(OC(CC/C=C/C=O)=O)COC(CCCCCCCCC)=O |
MS Spectra | - |
Status | Active (generated by computational methods) |