In-Silico Structure database (LMISSD)
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LM ID | LMGP02019ABT |
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Common Name | PE(10:0/22:4(7Z,10Z,13Z,16Z)) |
Systematic Name | 1-decanoyl-2-(7Z,10Z,13Z,16Z-docosatetraenoyl)-sn-glycero-3-phosphoethanolamine |
Synonyms | PE(32:4); PE(10:0_22:4) |
Exact Mass | |
Formula | C37H66NO8P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoethanolamines [GP02] |
Sub Class | Diacylglycerophosphoethanolamines [GP0201] |
PubChem Compound ID (CID) | - |
InChIKey | FUDHNOJCVNFEKB-YFCDWVEUSA-N |
InChI | InChI=1S/C37H66NO8P/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-20-21-22-24-26-28-30-3 7(40)46-35(34-45-47(41,42)44-32-31-38)33-43-36(39)29-27-25-23-10-8-6-4-2/h11-12, 14-15,17-18,20-21,35H,3-10,13,16,19,22-34,38H2,1-2H3,(H,41,42)/b12-11-,15-14-,18 -17-,21-20-/t35-/m1/s1 |
SMILES | [C@](COP(=O)(O)OCCN)([H])(OC(CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)=O)COC(CCCCCCCCC) =O |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |