In-Silico Structure database (LMISSD)
| |
LM ID | LMGP20069BZA |
---|---|
Common Name | PG(18:4(6Z,9Z,12Z,15Z)/2:0) |
Systematic Name | 1-(6Z,9Z,12Z,15Z-octadecatetraenoyl)-2-acetyl-sn-glycero-3-phospho-(1'-sn- glycerol) |
Synonyms | PG(20:4); PG(18:4/2:0) |
Exact Mass | |
Formula | C26H43O10P |
Category | Glycerophospholipids [GP] |
Main Class | Oxidized glycerophospholipids [GP20] |
Sub Class | Oxidized glycerophosphoglycerols [GP2006] |
PubChem Compound ID (CID) | - |
InChIKey | GZVNLNLNNQUNQL-GGTQBDDLSA-N |
InChI | InChI=1S/C26H43O10P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-26(30)33-21-25(3 6-23(2)28)22-35-37(31,32)34-20-24(29)19-27/h4-5,7-8,10-11,13-14,24-25,27,29H,3,6 ,9,12,15-22H2,1-2H3,(H,31,32)/b5-4-,8-7-,11-10-,14-13-/t24-,25+/m0/s1 |
SMILES | [H][C@](O)(CO)COP(OC[C@]([H])(OC(C)=O)COC(CCCC/C=C\C/C=C\C/C=C\C/C=C\CC)=O)(=O)O |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |