In-Silico Structure database (LMISSD)
| |
LM ID | LMGP01029AAH |
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Common Name | PC(O-14:0/15:1(9Z)) |
Systematic Name | 1-tetradecyl-2-(9Z-pentadecenoyl)-sn-glycero-3-phosphocholine |
Synonyms | PC(O-29:1); PC(O-14:0/15:1) |
Exact Mass | |
Formula | C37H74NO7P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphocholines [GP01] |
Sub Class | 1-alkyl,2-acylglycerophosphocholines [GP0102] |
PubChem Compound ID (CID) | - |
InChIKey | UGKBPLMBOZXKSE-ZYODFBQNSA-N |
InChI | InChI=1S/C37H74NO7P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-37(39)45-36(35-44-46 (40,41)43-33-31-38(3,4)5)34-42-32-29-27-25-23-21-19-17-15-13-11-9-7-2/h14,16,36H ,6-13,15,17-35H2,1-5H3/b16-14-/t36-/m1/s1 |
SMILES | [C@](COP(=O)([O-])OCC[N+](C)(C)C)([H])(OC(CCCCCCC/C=C\CCCCC)=O)COCCCCCCCCCCCCCC |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |