EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C42H79O10P |
| Net Charge | 0 |
| Average Mass | 775.058 |
| Monoisotopic Mass | 774.54109 |
| SMILES | [H][C@](O)(CO)COP(=O)(O)OC[C@@]([H])(COC(=O)CCCCCCC/C=C\CCCCCCCC)OC(=O)CCCCCCCCC/C=C\CCCCCC |
| InChI | InChI=1S/C42H79O10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-41(45)49-37-40(38-51-53(47,48)50-36-39(44)35-43)52-42(46)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h14,16-17,19,39-40,43-44H,3-13,15,18,20-38H2,1-2H3,(H,47,48)/b16-14-,19-17-/t39-,40+/m0/s1 |
| InChIKey | NTMBJQYQYMPGRM-MYVKIHSOSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | blood (UBERON:0000178) | PubMed (20671299) |
| Roles Classification |
|---|
| Biological Roles: | Escherichia coli metabolite Any bacterial metabolite produced during a metabolic reaction in Escherichia coli. mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| PG(18:1(9Z)/18:1(11Z)) (CHEBI:89410) is a phosphatidylglycerol (CHEBI:17517) |
| Synonyms | Source |
|---|---|
| Phosphatidylglycerol(36:2) | HMDB |
| Phosphatidylglycerol(18:1n9/18:1n7) | HMDB |
| 1-(9Z-Octadecenoyl)-2-(11Z-octadecenoyl)-sn-glycero-3-phospho-(1'-glycerol) | HMDB |
| 1-Oleoyl-2-vaccenoyl-sn-glycero-3-phosphoglycerol | HMDB |
| PG(18:1/18:1) | HMDB |
| PG(18:1w9/18:1w7) | HMDB |
| Manual Xrefs | Databases |
|---|---|
| HMDB0010633 | HMDB |
| Citations |
|---|