In-Silico Structure database (LMISSD)
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LM ID | LMGP10019DZ0 |
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Common Name | PA(22:6(4Z,7Z,10Z,12E,16Z,19Z)/10:0) |
Systematic Name | 1-(4Z,7Z,10Z,12E,16Z,19Z-docosahexaenoyl)-2-decanoyl-sn-glycero-3-phosphate |
Synonyms | PA(32:6); PA(10:0_22:6) |
Exact Mass | |
Formula | C35H57O8P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphates [GP10] |
Sub Class | Diacylglycerophosphates [GP1001] |
PubChem Compound ID (CID) | - |
InChIKey | PMBWAYKCZZBEKK-QLAZTZEFSA-N |
InChI | InChI=1S/C35H57O8P/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-20-21-22-24-25-27-29-34 (36)41-31-33(32-42-44(38,39)40)43-35(37)30-28-26-23-10-8-6-4-2/h5,7,11-12,15-18, 20-21,24-25,33H,3-4,6,8-10,13-14,19,22-23,26-32H2,1-2H3,(H2,38,39,40)/b7-5-,12-1 1-,16-15+,18-17-,21-20-,25-24-/t33-/m1/s1 |
SMILES | [C@](COP(=O)(O)O)([H])(OC(CCCCCCCCC)=O)COC(CC/C=C\C/C=C\C/C=C\C=C\CC/C=C\C/C=C\C C)=O |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |