In-Silico Structure database (LMISSD)
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LM ID | LMGP10029ARN |
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Common Name | PA(O-18:1(9Z)/20:4(5E,8E,11E,14E)) |
Systematic Name | 1-(9Z-octadecenyl)-2-(5E,8E,11E,14E-eicosatetraenoyl)-sn-glycero-3-phosphate |
Synonyms | PA(O-38:5); PA(O-18:1/20:4) |
Exact Mass | |
Formula | C41H73O7P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphates [GP10] |
Sub Class | 1-alkyl,2-acylglycerophosphates [GP1002] |
PubChem Compound ID (CID) | - |
InChIKey | XXNDXYPDJRWJNS-VZIHFHMMSA-N |
InChI | InChI=1S/C41H73O7P/c1-3-5-7-9-11-13-15-17-19-21-22-24-26-28-30-32-34-36-41(42)48 -40(39-47-49(43,44)45)38-46-37-35-33-31-29-27-25-23-20-18-16-14-12-10-8-6-4-2/h1 1,13,17-20,22,24,28,30,40H,3-10,12,14-16,21,23,25-27,29,31-39H2,1-2H3,(H2,43,44, 45)/b13-11+,19-17+,20-18-,24-22+,30-28+/t40-/m1/s1 |
SMILES | [C@](COP(=O)(O)O)([H])(OC(CCC/C=C/C/C=C/C/C=C/C/C=C/CCCCC)=O)COCCCCCCCC/C=C\CCCC CCCC |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |