In-Silico Structure database (LMISSD)
| |
LM ID | LMGP10019AHV |
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Common Name | PA(13:0/18:2(2E,4E)) |
Systematic Name | 1-tridecanoyl-2-(2E,4E-octadecadienoyl)-sn-glycero-3-phosphate |
Synonyms | PA(31:2); PA(13:0_18:2) |
Exact Mass | |
Formula | C34H63O8P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphates [GP10] |
Sub Class | Diacylglycerophosphates [GP1001] |
PubChem Compound ID (CID) | - |
InChIKey | OQMPJMLIANIIMR-HXYNWLGUSA-N |
InChI | InChI=1S/C34H63O8P/c1-3-5-7-9-11-13-15-16-17-18-19-21-23-25-27-29-34(36)42-32(31 -41-43(37,38)39)30-40-33(35)28-26-24-22-20-14-12-10-8-6-4-2/h23,25,27,29,32H,3-2 2,24,26,28,30-31H2,1-2H3,(H2,37,38,39)/b25-23+,29-27+/t32-/m1/s1 |
SMILES | [C@](COP(=O)(O)O)([H])(OC(/C=C/C=C/CCCCCCCCCCCCC)=O)COC(CCCCCCCCCCCC)=O |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |