In-Silico Structure database (LMISSD)
| |
LM ID | LMGP10029AHY |
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Common Name | PA(O-16:1(11Z)/18:2(9E,12E)) |
Systematic Name | 1-(11Z-hexadecenyl)-2-(9E,12E-octadecadienoyl)-sn-glycero-3-phosphate |
Synonyms | PA(O-34:3); PA(O-16:1/18:2) |
Exact Mass | |
Formula | C37H69O7P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphates [GP10] |
Sub Class | 1-alkyl,2-acylglycerophosphates [GP1002] |
PubChem Compound ID (CID) | - |
InChIKey | UCQDTUZESJSXSL-LHZPIHQHSA-N |
InChI | InChI=1S/C37H69O7P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-37(38)44-36(35 -43-45(39,40)41)34-42-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h10-13,17,19,3 6H,3-9,14-16,18,20-35H2,1-2H3,(H2,39,40,41)/b12-10-,13-11+,19-17+/t36-/m1/s1 |
SMILES | [C@](COP(=O)(O)O)([H])(OC(CCCCCCC/C=C/C/C=C/CCCCC)=O)COCCCCCCCCCC/C=C\CCCC |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |