EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C42H80NO7P |
| Net Charge | 0 |
| Average Mass | 742.076 |
| Monoisotopic Mass | 741.56724 |
| SMILES | CCCCCC/C=C\CCCCCCCC/C=C\OC(COC(=O)CCCCCCC/C=C\CCCCCC)COP(=O)([O-])OCC[N+](C)(C)C |
| InChI | InChI=1S/C42H80NO7P/c1-6-8-10-12-14-16-18-20-21-22-24-26-28-30-32-34-37-47-41(40-50-51(45,46)49-38-36-43(3,4)5)39-48-42(44)35-33-31-29-27-25-23-19-17-15-13-11-9-7-2/h16-19,34,37,41H,6-15,20-33,35-36,38-40H2,1-5H3/b18-16-,19-17-,37-34- |
| InChIKey | ZFACUKICYTXONE-IWDZABBFSA-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(16:1(9Z)/P-18:1(11Z)) (CHEBI:89648) is a glycerophosphocholine (CHEBI:36313) |
| Synonyms | Source |
|---|---|
| Phosphatidylcholine(16:1/18:1) | HMDB |
| [2-({3-[(9Z)-hexadec-9-enoyloxy]-2-[(1Z,11Z)-octadeca-1,11-dien-1-yloxy]propyl phosphonato}oxy)ethyl]trimethylazanium | HMDB |
| GPCho(34:2) | HMDB |
| Lecithin | HMDB |
| GPCho(16:1n7/18:1n7) | HMDB |
| Phosphatidylcholine(16:1n7/18:1n7) | HMDB |
| Manual Xrefs | Databases |
|---|---|
| PHOSPHATIDYLCHOLINE | MetaCyc |
| Lecithin | Wikipedia |
| HMDB0008029 | HMDB |
| Citations |
|---|