EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:179928 - PE(15:1(9Z)/17:2(9Z,12Z))
| Formula | C37H68NO8P |
| Net Charge | 0 |
| Average Mass | 685.924 |
| Monoisotopic Mass | 685.46825 |
| SMILES | CCCC/C=C\C/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\CCCCC)COP(=O)(O)OCCN |
| InChI | InChI=1S/C37H68NO8P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-37(40)46-35(34-45-47(41,42)44-32-31-38)33-43-36(39)29-27-25-23-21-19-16-14-12-10-8-6-4-2/h9,11-12,14-15,17,35H,3-8,10,13,16,18-34,38H2,1-2H3,(H,41,42)/b11-9-,14-12-,17-15-/t35-/m1/s1 |
| InChIKey | WSPJTGKOYNVEPC-QKXMIXIJSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| PE(15:1(9Z)/17:2(9Z,12Z)) (CHEBI:179928) is a 1,2-diacyl-sn-glycero-3-phosphoethanolamine (CHEBI:64674) |
| IUPAC Name |
|---|
| [(2R)-1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-[(Z)-pentadec-9-enoyl]oxypropan-2-yl] (9Z,12Z)-heptadeca-9,12-dienoate |
| Manual Xrefs | Databases |
|---|---|
| LMGP02010484 | LIPID MAPS |