In-Silico Structure Database (LMISSD)
Common Name
PA(31:0/26:2(5E,9Z))
Systematic Name
1-hentriacontanoyl-2-(5Z,9E-hexacosadienoyl)-sn-glycero-3-phosphate
LM ID
LMGP10019E2R
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
994.832958
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphates [GP10]
Diacylglycerophosphates [GP1001]
String Representations
InChiKey (Click to copy)
ZOTNJZUMPPQPHZ-GUQPXINXSA-N
InChi (Click to copy)
InChI=1S/C60H115O8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-28-29-30-31-33-34-36-38-40-42-44-46-48-50-52-54-59(61)66-56-58(57-67-69(63,64)65)68-60(62)55-53-51-49-47-45-43-41-39-37-35-32-26-24-22-20-18-16-14-12-10-8-6-4-2/h39,41,47,49,58H,3-38,40,42-46,48,50-57H2,1-2H3,(H2,63,64,65)/b41-39-,49-47+/t58-/m1/s1
SMILES (Click to copy)
[C@](COP(=O)(O)O)([H])(OC(CCC/C=C/CC/C=C\CCCCCCCCCCCCCCCC)=O)COC(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)=O