In-Silico Structure database (LMISSD)
| |
LM ID | LMGP05029AA5 |
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Common Name | PGP(O-14:0/18:3(9Z,12Z,15Z)) |
Systematic Name | 1-tetradecyl-2-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycero-3-phospho-(1'-sn- glycerol-3'-phosphate) |
Synonyms | PGP(O-32:3); PGP(O-14:0/18:3) |
Exact Mass | |
Formula | C38H72O12P2 |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoglycerophosphates [GP05] |
Sub Class | 1-alkyl,2-acylglycerophosphoglycerophosphates [GP0502] |
PubChem Compound ID (CID) | - |
InChIKey | ZIURDEXXGKOPCP-PZLOIPQWSA-N |
InChI | InChI=1S/C38H72O12P2/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-38(40)50-37( 35-49-52(44,45)48-33-36(39)32-47-51(41,42)43)34-46-31-29-27-25-23-21-16-14-12-10 -8-6-4-2/h5,7,11,13,17-18,36-37,39H,3-4,6,8-10,12,14-16,19-35H2,1-2H3,(H,44,45)( H2,41,42,43)/b7-5-,13-11-,18-17-/t36-,37+/m0/s1 |
SMILES | [C@]([H])(OC(CCCCCCC/C=C\C/C=C\C/C=C\CC)=O)(COP(=O)(O)OC[C@@]([H])(O)COP(O)(O)=O )COCCCCCCCCCCCCCC |
MS Spectra | - |
Status | Active (generated by computational methods) |