In-Silico Structure database (LMISSD)
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LM ID | LMGP05019AF8 |
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Common Name | PGP(12:0/20:4(6E,8Z,11Z,14Z)) |
Systematic Name | 1-dodecanoyl-2-(6E,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycero-3-phospho-(1'-sn- glycerol-3'-phosphate) |
Synonyms | PGP(32:4); PGP(12:0_20:4) |
Exact Mass | |
Formula | C38H68O13P2 |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoglycerophosphates [GP05] |
Sub Class | Diacylglycerophosphoglycerophosphates [GP0501] |
PubChem Compound ID (CID) | - |
InChIKey | ZGCKYAHSSPRMBG-SYJBGYNKSA-N |
InChI | InChI=1S/C38H68O13P2/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-22-24-26-28-30-38(41) 51-36(33-47-37(40)29-27-25-23-21-12-10-8-6-4-2)34-50-53(45,46)49-32-35(39)31-48- 52(42,43)44/h11,13,15-16,18-20,22,35-36,39H,3-10,12,14,17,21,23-34H2,1-2H3,(H,45 ,46)(H2,42,43,44)/b13-11-,16-15-,19-18-,22-20+/t35-,36+/m0/s1 |
SMILES | [H][C@](O)(COP(O)(O)=O)COP(OC[C@]([H])(OC(CCCC/C=C/C=C\C/C=C\C/C=C\CCCCC)=O)COC( CCCCCCCCCCC)=O)(=O)O |
MS Spectra | - |
Status | Active (generated by computational methods) |