In-Silico Structure database (LMISSD)
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LM ID | LMGP05019DVF |
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Common Name | PGP(22:5(4Z,7Z,10Z,13Z,16Z)/11:0) |
Systematic Name | 1-(4Z,7Z,10Z,13Z,16Z-docosapentaenoyl)-2-undecanoyl-sn-glycero-3-phospho-(1'- sn-glycerol-3'-phosphate) |
Synonyms | PGP(33:5); PGP(11:0_22:5) |
Exact Mass | |
Formula | C39H68O13P2 |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoglycerophosphates [GP05] |
Sub Class | Diacylglycerophosphoglycerophosphates [GP0501] |
PubChem Compound ID (CID) | - |
InChIKey | TWALAZKFLWKECT-FBSWPSAYSA-N |
InChI | InChI=1S/C39H68O13P2/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-21-22-23-25-26-28-30- 38(41)48-34-37(52-39(42)31-29-27-24-12-10-8-6-4-2)35-51-54(46,47)50-33-36(40)32- 49-53(43,44)45/h11,13,15-16,18-19,21-22,25-26,36-37,40H,3-10,12,14,17,20,23-24,2 7-35H2,1-2H3,(H,46,47)(H2,43,44,45)/b13-11-,16-15-,19-18-,22-21-,26-25-/t36-,37+ /m0/s1 |
SMILES | [H][C@](O)(COP(O)(O)=O)COP(OC[C@]([H])(OC(CCCCCCCCCC)=O)COC(CC/C=C\C/C=C\C/C=C\C /C=C\C/C=C\CCCCC)=O)(=O)O |
MS Spectra | - |
Status | Active (generated by computational methods) |