In-Silico Structure database (LMISSD)
| |
LM ID | LMGP01039AQL |
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Common Name | PC(P-20:1(11Z)/15:0) |
Systematic Name | 1-(1Z,11Z-eicosadienyl)-2-pentadecanoyl-sn-glycero-3-phosphocholine |
Synonyms | PC(P-35:1); PC(P-20:1/15:0) |
Exact Mass | |
Formula | C43H84NO7P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphocholines [GP01] |
Sub Class | 1-(1Z-alkenyl),2-acylglycerophosphocholines [GP0103] |
PubChem Compound ID (CID) | - |
InChIKey | MOEXISNVNNCHHB-OYDUFMLBSA-N |
InChI | InChI=1S/C43H84NO7P/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-27-29-31-33-35-38-48 -40-42(41-50-52(46,47)49-39-37-44(3,4)5)51-43(45)36-34-32-30-28-26-19-17-15-13-1 1-9-7-2/h20-21,35,38,42H,6-19,22-34,36-37,39-41H2,1-5H3/b21-20-,38-35-/t42-/m1/s 1 |
SMILES | [C@](COP(=O)([O-])OCC[N+](C)(C)C)([H])(OC(CCCCCCCCCCCCCC)=O)CO/C=C\CCCCCCCC/C=C\ CCCCCCCC |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |