In-Silico Structure database (LMISSD)
| |
LM ID | LMGP05019ABG |
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Common Name | PGP(10:0/20:3(5Z,8Z,11Z)) |
Systematic Name | 1-decanoyl-2-(5Z,8Z,11Z-eicosatrienoyl)-sn-glycero-3-phospho-(1'-sn-glycerol- 3'-phosphate) |
Synonyms | PGP(30:3); PGP(10:0_20:3) |
Exact Mass | |
Formula | C36H66O13P2 |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoglycerophosphates [GP05] |
Sub Class | Diacylglycerophosphoglycerophosphates [GP0501] |
PubChem Compound ID (CID) | - |
InChIKey | QQCOPRDAZZZAHF-MHFNPBARSA-N |
InChI | InChI=1S/C36H66O13P2/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-20-22-24-26-28-36(39) 49-34(31-45-35(38)27-25-23-21-10-8-6-4-2)32-48-51(43,44)47-30-33(37)29-46-50(40, 41)42/h14-15,17-18,20,22,33-34,37H,3-13,16,19,21,23-32H2,1-2H3,(H,43,44)(H2,40,4 1,42)/b15-14-,18-17-,22-20-/t33-,34+/m0/s1 |
SMILES | [H][C@](O)(COP(O)(O)=O)COP(OC[C@]([H])(OC(CCC/C=C\C/C=C\C/C=C\CCCCCCCC)=O)COC(CC CCCCCCC)=O)(=O)O |
MS Spectra | - |
Status | Active (generated by computational methods) |