In-Silico Structure database (LMISSD)
| |
LM ID | LMGP20029ABO |
---|---|
Common Name | PE(10:0/4:1(3E)) |
Systematic Name | 1-decanoyl-2-3E-butenoyl-sn-glycero-3-phosphoethanolamine |
Synonyms | PE(14:1); PE(10:0/4:1) |
Exact Mass | |
Formula | C19H36NO8P |
Category | Glycerophospholipids [GP] |
Main Class | Oxidized glycerophospholipids [GP20] |
Sub Class | Oxidized glycerophosphoethanolamines [GP2002] |
PubChem Compound ID (CID) | - |
InChIKey | NFVMANXILRMWSM-QGZVFWFLSA-N |
InChI | InChI=1S/C19H36NO8P/c1-3-5-6-7-8-9-10-12-18(21)25-15-17(28-19(22)11-4-2)16-27-29 (23,24)26-14-13-20/h4,17H,2-3,5-16,20H2,1H3,(H,23,24)/t17-/m1/s1 |
SMILES | [C@](COP(=O)(O)OCCN)([H])(OC(CC=C)=O)COC(CCCCCCCCC)=O |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |