In-Silico Structure database (LMISSD)
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LM ID | LMGP10029AA7 |
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Common Name | PA(O-14:0/18:4(9E,11E,13E,15E)) |
Systematic Name | 1-tetradecyl-2-(9E,11E,13E,15E-octadecatetraenoyl)-sn-glycero-3-phosphate |
Synonyms | PA(O-32:4); PA(O-14:0/18:4) |
Exact Mass | |
Formula | C35H63O7P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphates [GP10] |
Sub Class | 1-alkyl,2-acylglycerophosphates [GP1002] |
PubChem Compound ID (CID) | - |
InChIKey | XUAIBRCZXPPWGL-VQZCWIPSSA-N |
InChI | InChI=1S/C35H63O7P/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-35(36)42-34(33 -41-43(37,38)39)32-40-31-29-27-25-23-21-16-14-12-10-8-6-4-2/h5,7,9,11,13,15,17-1 8,34H,3-4,6,8,10,12,14,16,19-33H2,1-2H3,(H2,37,38,39)/b7-5+,11-9+,15-13+,18-17+/ t34-/m1/s1 |
SMILES | [C@](COP(=O)(O)O)([H])(OC(CCCCCCC/C=C/C=C/C=C/C=C/CC)=O)COCCCCCCCCCCCCCC |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |