EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C44H76NO10P |
| Net Charge | 0 |
| Average Mass | 810.063 |
| Monoisotopic Mass | 809.52068 |
| SMILES | [H][C@@](COC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)(COP(=O)(O)OC[C@]([H])(N)C(=O)O)OC(=O)CCCCCCC/C=C\CCCCCCCC |
| InChI | InChI=1S/C44H76NO10P/c1-3-5-7-9-11-13-15-17-19-20-22-23-25-27-29-31-33-35-42(46)52-37-40(38-53-56(50,51)54-39-41(45)44(48)49)55-43(47)36-34-32-30-28-26-24-21-18-16-14-12-10-8-6-4-2/h11,13,17-19,21-23,27,29,40-41H,3-10,12,14-16,20,24-26,28,30-39,45H2,1-2H3,(H,48,49)(H,50,51)/b13-11-,19-17-,21-18-,23-22-,29-27-/t40-,41+/m1/s1 |
| InChIKey | LGGPSGMSHAHERE-VIPJVEDPSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | blood (UBERON:0000178) | PubMed (20671299) |
| Roles Classification |
|---|
| Chemical Roles: | Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). |
| Biological Role: | human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| PS(20:4(5Z,8Z,11Z,14Z)/18:1(9Z)) (CHEBI:88537) is a phosphatidyl-L-serine (CHEBI:18303) |
| Synonyms | Source |
|---|---|
| 1-Arachidonoyl-2-oleoyl-sn-glycero-3-phosphoserine | HMDB |
| (2S)-2-amino-3-({hydroxy[(2R)-3-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyloxy]-2-[(9Z)-octadec-9-enoyloxy]propoxy]phosphoryl}oxy)propanoic acid | HMDB |
| Phosphatidylserine(20:4/18:1) | HMDB |
| Phosphatidylserine(20:4n6/18:1n9) | HMDB |
| Phosphatidylserine(20:4w6/18:1w9) | HMDB |
| Phosphatidylserine(38:5) | HMDB |
| Manual Xrefs | Databases |
|---|---|
| HMDB0012434 | HMDB |
| Citations |
|---|