In-Silico Structure database (LMISSD)
| |
LM ID | LMGP02019ABF |
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Common Name | PE(10:0/20:2(5Z,8Z)) |
Systematic Name | 1-decanoyl-2-(5Z,8Z-eicosadienoyl)-sn-glycero-3-phosphoethanolamine |
Synonyms | PE(30:2); PE(10:0_20:2) |
Exact Mass | |
Formula | C35H66NO8P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoethanolamines [GP02] |
Sub Class | Diacylglycerophosphoethanolamines [GP0201] |
PubChem Compound ID (CID) | - |
InChIKey | VDOACAKQXNNGKV-IHDPPVCCSA-N |
InChI | InChI=1S/C35H66NO8P/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-20-22-24-26-28-35(38)4 4-33(32-43-45(39,40)42-30-29-36)31-41-34(37)27-25-23-21-10-8-6-4-2/h17-18,20,22, 33H,3-16,19,21,23-32,36H2,1-2H3,(H,39,40)/b18-17-,22-20-/t33-/m1/s1 |
SMILES | [C@](COP(=O)(O)OCCN)([H])(OC(CCC/C=C\C/C=C\CCCCCCCCCCC)=O)COC(CCCCCCCCC)=O |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |