In-Silico Structure database (LMISSD)
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LM ID | LMGP05039AA6 |
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Common Name | PGP(P-16:0/18:4(6Z,9Z,12Z,15Z)) |
Systematic Name | 1-(1Z-hexadecenyl)-2-(6Z,9Z,12Z,15Z-octadecatetraenoyl)-sn-glycero-3-phospho- (1'-sn-glycerol-3'-phosphate) |
Synonyms | PGP(P-34:4); PGP(P-16:0/18:4) |
Exact Mass | |
Formula | C40H72O12P2 |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoglycerophosphates [GP05] |
Sub Class | 1-(1Z-alkenyl),2-acylglycerophosphoglycerophosphates [GP0503] |
PubChem Compound ID (CID) | - |
InChIKey | NWCKTKHDACDRNA-BLYQLMFZSA-N |
InChI | InChI=1S/C40H72O12P2/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-40(42)52-39( 37-51-54(46,47)50-35-38(41)34-49-53(43,44)45)36-48-33-31-29-27-25-23-21-18-16-14 -12-10-8-6-4-2/h5,7,11,13,17,19,22,24,31,33,38-39,41H,3-4,6,8-10,12,14-16,18,20- 21,23,25-30,32,34-37H2,1-2H3,(H,46,47)(H2,43,44,45)/b7-5-,13-11-,19-17-,24-22-,3 3-31-/t38-,39+/m0/s1 |
SMILES | [C@]([H])(OC(CCCC/C=C\C/C=C\C/C=C\C/C=C\CC)=O)(COP(=O)(O)OC[C@@]([H])(O)COP(O)(O )=O)CO/C=C\CCCCCCCCCCCCCC |
MS Spectra | - |
Status | Active (generated by computational methods) |