In-Silico Structure database (LMISSD)
| |
LM ID | LMGP20019AK1 |
---|---|
Common Name | PC(14:1(9Z)/4:0(4Ke)) |
Systematic Name | 1-(9Z-tetradecenoyl)-2-(4-oxobutyryl)-sn-glycero-3-phosphocholine |
Synonyms | PC(18:1(Ke)); PC(14:1/4:0(Ke)) |
Exact Mass | |
Formula | C26H48NO9P |
Category | Glycerophospholipids [GP] |
Main Class | Oxidized glycerophospholipids [GP20] |
Sub Class | Oxidized glycerophosphocholines [GP2001] |
PubChem Compound ID (CID) | - |
InChIKey | UZBGEKUGWPBGJC-XXXZYALBSA-N |
InChI | InChI=1S/C26H48NO9P/c1-5-6-7-8-9-10-11-12-13-14-15-17-25(29)33-22-24(36-26(30)18 -16-20-28)23-35-37(31,32)34-21-19-27(2,3)4/h8-9,20,24H,5-7,10-19,21-23H2,1-4H3/b 9-8-/t24-/m1/s1 |
SMILES | [C@](COP(=O)([O-])OCC[N+](C)(C)C)([H])(OC(CCC=O)=O)COC(CCCCCCC/C=C\CCCC)=O |
MS Spectra | - |
Status | Active (generated by computational methods) |