In-Silico Structure database (LMISSD)
| |
LM ID | LMGP04039ASX |
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Common Name | PG(P-20:1(9Z)/15:1(9Z)) |
Systematic Name | 1-(1Z,9Z-eicosadienyl)-2-(9Z-pentadecenoyl)-sn-glycero-3-phospho-(1'-sn- glycerol) |
Synonyms | PG(P-35:2); PG(P-20:1/15:1) |
Exact Mass | |
Formula | C41H77O9P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoglycerols [GP04] |
Sub Class | 1-(1Z-alkenyl),2-acylglycerophosphoglycerols [GP0403] |
PubChem Compound ID (CID) | - |
InChIKey | LCOFYOOFZRJUNC-WLKGOATASA-N |
InChI | InChI=1S/C41H77O9P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-47-37 -40(38-49-51(45,46)48-36-39(43)35-42)50-41(44)33-31-29-27-25-23-16-14-12-10-8-6- 4-2/h12,14,19-20,32,34,39-40,42-43H,3-11,13,15-18,21-31,33,35-38H2,1-2H3,(H,45,4 6)/b14-12-,20-19-,34-32-/t39-,40+/m0/s1 |
SMILES | [C@]([H])(OC(CCCCCCC/C=C\CCCCC)=O)(COP(=O)(O)OC[C@@]([H])(O)CO)CO/C=C\CCCCCC/C=C \CCCCCCCCCC |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |