In-Silico Structure database (LMISSD)
| |
LM ID | LMGP02019A1Z |
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Common Name | PE(17:1(9Z)/11:0) |
Systematic Name | 1-(9Z-heptadecenoyl)-2-undecanoyl-sn-glycero-3-phosphoethanolamine |
Synonyms | PE(28:1); PE(11:0_17:1) |
Exact Mass | |
Formula | C33H64NO8P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoethanolamines [GP02] |
Sub Class | Diacylglycerophosphoethanolamines [GP0201] |
PubChem Compound ID (CID) | - |
InChIKey | LVJJWCISCHXOHT-BPRWFLIUSA-N |
InChI | InChI=1S/C33H64NO8P/c1-3-5-7-9-11-13-14-15-16-17-18-20-21-23-25-32(35)39-29-31(3 0-41-43(37,38)40-28-27-34)42-33(36)26-24-22-19-12-10-8-6-4-2/h14-15,31H,3-13,16- 30,34H2,1-2H3,(H,37,38)/b15-14-/t31-/m1/s1 |
SMILES | [C@](COP(=O)(O)OCCN)([H])(OC(CCCCCCCCCC)=O)COC(CCCCCCC/C=C\CCCCCCC)=O |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |