In-Silico Structure database (LMISSD)
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LM ID | LMGP10039DES |
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Common Name | PA(P-14:0/20:4(7E,10E,13E,16E)) |
Systematic Name | 1-(1Z-tetradecenyl)-2-(7E,10E,13E,16E-eicosatetraenoyl)-sn-glycero-3-phosphate |
Synonyms | PA(P-34:4); PA(P-14:0/20:4) |
Exact Mass | |
Formula | C37H65O7P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphates [GP10] |
Sub Class | 1-(1Z-alkenyl),2-acylglycerophosphates [GP1003] |
PubChem Compound ID (CID) | - |
InChIKey | JERBSGCIWFKUAL-GJGGQXILSA-N |
InChI | InChI=1S/C37H65O7P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-37(38)44 -36(35-43-45(39,40)41)34-42-33-31-29-27-25-23-16-14-12-10-8-6-4-2/h7,9,13,15,18- 19,21-22,31,33,36H,3-6,8,10-12,14,16-17,20,23-30,32,34-35H2,1-2H3,(H2,39,40,41)/ b9-7+,15-13+,19-18+,22-21+,33-31-/t36-/m1/s1 |
SMILES | [C@](COP(=O)(O)O)([H])(OC(CCCCC/C=C/C/C=C/C/C=C/C/C=C/CCC)=O)CO/C=C\CCCCCCCCCCCC |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |