In-Silico Structure database (LMISSD)
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LM ID | LMGP10019ADZ |
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Common Name | PA(11:0/20:5(5Z,8Z,11Z,14Z,17Z)) |
Systematic Name | 1-undecanoyl-2-(5Z,8Z,11Z,14Z,17Z-eicosapentaenoyl)-sn-glycero-3-phosphate |
Synonyms | PA(31:5); PA(11:0_20:5) |
Exact Mass | |
Formula | C34H57O8P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphates [GP10] |
Sub Class | Diacylglycerophosphates [GP1001] |
PubChem Compound ID (CID) | - |
InChIKey | DIUZXHOKWYSCLU-ZGSVFEJWSA-N |
InChI | InChI=1S/C34H57O8P/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-21-23-25-27-29-34(36)42 -32(31-41-43(37,38)39)30-40-33(35)28-26-24-22-12-10-8-6-4-2/h5,7,11,13,15-16,18- 19,21,23,32H,3-4,6,8-10,12,14,17,20,22,24-31H2,1-2H3,(H2,37,38,39)/b7-5-,13-11-, 16-15-,19-18-,23-21-/t32-/m1/s1 |
SMILES | [C@](COP(=O)(O)O)([H])(OC(CCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)=O)COC(CCCCCCCCCC)= O |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |