In-Silico Structure database (LMISSD)
| |
LM ID | LMGP05019AD3 |
---|---|
Common Name | PGP(11:0/22:2(13Z,16Z)) |
Systematic Name | 1-undecanoyl-2-(13Z,16Z-docosadienoyl)-sn-glycero-3-phospho-(1'-sn-glycerol-3'- phosphate) |
Synonyms | PGP(33:2); PGP(11:0_22:2) |
Exact Mass | |
Formula | C39H74O13P2 |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoglycerophosphates [GP05] |
Sub Class | Diacylglycerophosphoglycerophosphates [GP0501] |
PubChem Compound ID (CID) | - |
InChIKey | NWFVUYIZOKCXIP-PXDIEFBSSA-N |
InChI | InChI=1S/C39H74O13P2/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-21-22-23-25-27-29-31- 39(42)52-37(34-48-38(41)30-28-26-24-12-10-8-6-4-2)35-51-54(46,47)50-33-36(40)32- 49-53(43,44)45/h11,13,15-16,36-37,40H,3-10,12,14,17-35H2,1-2H3,(H,46,47)(H2,43,4 4,45)/b13-11-,16-15-/t36-,37+/m0/s1 |
SMILES | [H][C@](O)(COP(O)(O)=O)COP(OC[C@]([H])(OC(CCCCCCCCCCC/C=C\C/C=C\CCCCC)=O)COC(CCC CCCCCCC)=O)(=O)O |
MS Spectra | - |
Status | Active (generated by computational methods) |