In-Silico Structure database (LMISSD)
| |
LM ID | LMGP10029AQT |
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Common Name | PA(O-18:1(9Z)/18:0) |
Systematic Name | 1-(9Z-octadecenyl)-2-octadecanoyl-sn-glycero-3-phosphate |
Synonyms | PA(O-36:1); PA(O-18:1/18:0) |
Exact Mass | |
Formula | C39H77O7P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphates [GP10] |
Sub Class | 1-alkyl,2-acylglycerophosphates [GP1002] |
PubChem Compound ID (CID) | - |
InChIKey | OWVZFQDCLGAXFL-NPBIGWJUSA-N |
InChI | InChI=1S/C39H77O7P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-44-36-38(37 -45-47(41,42)43)46-39(40)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17,19,3 8H,3-16,18,20-37H2,1-2H3,(H2,41,42,43)/b19-17-/t38-/m1/s1 |
SMILES | [C@](COP(=O)(O)O)([H])(OC(CCCCCCCCCCCCCCCCC)=O)COCCCCCCCC/C=C\CCCCCCCC |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |