In-Silico Structure database (LMISSD)
| |
LM ID | LMGP05019C8D |
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Common Name | PGP(20:4(5Z,8Z,11Z,13E)/11:0) |
Systematic Name | 1-(5Z,8Z,11Z,13E-eicosatetraenoyl)-2-undecanoyl-sn-glycero-3-phospho-(1'-sn- glycerol-3'-phosphate) |
Synonyms | PGP(31:4); PGP(11:0_20:4) |
Exact Mass | |
Formula | C37H66O13P2 |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoglycerophosphates [GP05] |
Sub Class | Diacylglycerophosphoglycerophosphates [GP0501] |
PubChem Compound ID (CID) | - |
InChIKey | ORSLDPKOHNSXGF-JQHDEINNSA-N |
InChI | InChI=1S/C37H66O13P2/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-21-23-24-26-28-36(39) 46-32-35(50-37(40)29-27-25-22-12-10-8-6-4-2)33-49-52(44,45)48-31-34(38)30-47-51( 41,42)43/h13-16,18-19,21,23,34-35,38H,3-12,17,20,22,24-33H2,1-2H3,(H,44,45)(H2,4 1,42,43)/b14-13+,16-15-,19-18-,23-21-/t34-,35+/m0/s1 |
SMILES | [H][C@](O)(COP(O)(O)=O)COP(OC[C@]([H])(OC(CCCCCCCCCC)=O)COC(CCC/C=C\C/C=C\C/C=C\ C=C\CCCCCC)=O)(=O)O |
MS Spectra | - |
Status | Active (generated by computational methods) |