EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C42H80NO8P |
| Net Charge | 0 |
| Average Mass | 758.075 |
| Monoisotopic Mass | 757.56216 |
| SMILES | [H][C@@](COC(=O)CCCCCCC/C=C\CCCC)(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCC/C=C\CCCCCCCC |
| InChI | InChI=1S/C42H80NO8P/c1-6-8-10-12-14-16-18-19-20-21-22-23-25-27-29-31-33-35-42(45)51-40(39-50-52(46,47)49-37-36-43(3,4)5)38-48-41(44)34-32-30-28-26-24-17-15-13-11-9-7-2/h13,15,19-20,40H,6-12,14,16-18,21-39H2,1-5H3/b15-13-,20-19-/t40-/m1/s1 |
| InChIKey | OLUKQTJCNPHKRC-LYJZGNKWSA-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(14:1(9Z)/20:1(11Z)) (CHEBI:88919) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643) |
| Synonyms | Source |
|---|---|
| GPCho(14:1/20:1) | HMDB |
| (2-{[(2R)-2-[(11Z)-icos-11-enoyloxy]-3-[(9Z)-tetradec-9-enoyloxy]propyl phosphonato]oxy}ethyl)trimethylazanium | HMDB |
| PC(34:2) | HMDB |
| Phosphatidylcholine(14:1n5/20:1n9) | HMDB |
| GPCho(14:1w5/20:1w9) | HMDB |
| Lecithin | HMDB |
| Manual Xrefs | Databases |
|---|---|
| PHOSPHATIDYLCHOLINE | MetaCyc |
| HMDB0007912 | HMDB |
| Lecithin | Wikipedia |
| Citations |
|---|