In-Silico Structure database (LMISSD)
| |
LM ID | LMGP10019ABG |
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Common Name | PA(10:0/20:3(5Z,8Z,11Z)) |
Systematic Name | 1-decanoyl-2-(5Z,8Z,11Z-eicosatrienoyl)-sn-glycero-3-phosphate |
Synonyms | PA(30:3); PA(10:0_20:3) |
Exact Mass | |
Formula | C33H59O8P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphates [GP10] |
Sub Class | Diacylglycerophosphates [GP1001] |
PubChem Compound ID (CID) | - |
InChIKey | YAYPFWLAPJRDLR-CJPFFQKQSA-N |
InChI | InChI=1S/C33H59O8P/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-20-22-24-26-28-33(35)41 -31(30-40-42(36,37)38)29-39-32(34)27-25-23-21-10-8-6-4-2/h14-15,17-18,20,22,31H, 3-13,16,19,21,23-30H2,1-2H3,(H2,36,37,38)/b15-14-,18-17-,22-20-/t31-/m1/s1 |
SMILES | [C@](COP(=O)(O)O)([H])(OC(CCC/C=C\C/C=C\C/C=C\CCCCCCCC)=O)COC(CCCCCCCCC)=O |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |