In-Silico Structure database (LMISSD)
| |
LM ID | LMGP20079FMF |
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Common Name | PA(P-16:1(9Z)/4:0) |
Systematic Name | 1-(1Z,9Z-hexadecadienyl)-2-butyryl-sn-glycero-3-phosphate |
Synonyms | PA(P-20:1); PA(P-16:1/4:0) |
Exact Mass | |
Formula | C23H43O7P |
Category | Glycerophospholipids [GP] |
Main Class | Oxidized glycerophospholipids [GP20] |
Sub Class | Oxidized glycerophosphates [GP2007] |
PubChem Compound ID (CID) | - |
InChIKey | YPPZOPDNEFBMDX-HBQPYCDASA-N |
InChI | InChI=1S/C23H43O7P/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-19-28-20-22(21-29-31(2 5,26)27)30-23(24)18-4-2/h9-10,17,19,22H,3-8,11-16,18,20-21H2,1-2H3,(H2,25,26,27) /b10-9-,19-17-/t22-/m1/s1 |
SMILES | [C@](COP(=O)(O)O)([H])(OC(CCC)=O)CO/C=C\CCCCCC/C=C\CCCCCC |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |