EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C44H84NO7P |
| Net Charge | 0 |
| Average Mass | 770.130 |
| Monoisotopic Mass | 769.59854 |
| SMILES | CCCCCC/C=C\CCCCCCCC/C=C\OC(COC(=O)CCCCCCC/C=C\CCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C |
| InChI | InChI=1S/C44H84NO7P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-39-49-43(42-52-53(47,48)51-40-38-45(3,4)5)41-50-44(46)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h16,18,21,23,36,39,43H,6-15,17,19-20,22,24-35,37-38,40-42H2,1-5H3/b18-16-,23-21-,39-36- |
| InChIKey | AXIKTMZHHMNCSC-XDEIMXHKSA-N |
| Wikipedia |
|---|
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | |||
| saliva (UBERON:0001836) | Article (Dame, ZT. et al. (2014) The Human Saliva Metabolome (manuscript in preparation)) | ||
| urine (BTO:0001419) | PubMed (24023812) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| PC(18:1(9Z)/P-18:1(11Z)) (CHEBI:89595) is a glycerophosphocholine (CHEBI:36313) |
| Synonyms | Source |
|---|---|
| PC(18:1n9/18:1n7) | HMDB |
| GPCho(18:1n9/18:1n7) | HMDB |
| PC(18:1w9/18:1w7) | HMDB |
| Phosphatidylcholine(18:1n9/18:1n7) | HMDB |
| Phosphatidylcholine(18:1w9/18:1w7) | HMDB |
| Phosphatidylcholine(18:1/18:1) | HMDB |
| Manual Xrefs | Databases |
|---|---|
| PHOSPHATIDYLCHOLINE | MetaCyc |
| HMDB0008128 | HMDB |
| Lecithin | Wikipedia |
| Citations |
|---|