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CHEBI:136273 - N-(octadecanoyl)hexadecasphingosine-1-phosphocholine
| Formula | C39H79N2O6P |
| Net Charge | 0 |
| Average Mass | 703.043 |
| Monoisotopic Mass | 702.56757 |
| SMILES | CCCCCCCCCCC/C=C/[C@@H](O)[C@H](COP(=O)([O-])OCC[N+](C)(C)C)NC(=O)CCCCCCCCCCCCCCCCC |
| InChI | InChI=1S/C39H79N2O6P/c1-6-8-10-12-14-16-18-19-20-21-23-25-27-29-31-33-39(43)40-37(36-47-48(44,45)46-35-34-41(3,4)5)38(42)32-30-28-26-24-22-17-15-13-11-9-7-2/h30,32,37-38,42H,6-29,31,33-36H2,1-5H3,(H-,40,43,44,45)/b32-30+/t37-,38+/m0/s1 |
| InChIKey | OQCPQFVKIYWGRP-GWQJGLRPSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Papio hamadryas (ncbitaxon:9557) | - | MetaboLights (MTBLS426) |
| Roles Classification |
|---|
| Biological Role: | Papio hamadryas metabolite Any mammalian metabolite produced during a metabolic reaction in Papio hamadryas. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-(octadecanoyl)hexadecasphingosine-1-phosphocholine (CHEBI:136273) has functional parent hexadecasphing-4-enine (CHEBI:71052) |
| N-(octadecanoyl)hexadecasphingosine-1-phosphocholine (CHEBI:136273) has functional parent octadecanoic acid (CHEBI:28842) |
| N-(octadecanoyl)hexadecasphingosine-1-phosphocholine (CHEBI:136273) has role Papio hamadryas metabolite (CHEBI:137684) |
| N-(octadecanoyl)hexadecasphingosine-1-phosphocholine (CHEBI:136273) is a sphingomyelin 34:1 (CHEBI:72514) |
| IUPAC Name |
|---|
| (2S,3R,4E)-3-hydroxy-2-(octadecanoylamino)hexadec-4-en-1-yl 2-(trimethylazaniumyl)ethyl phosphate |
| Synonyms | Source |
|---|---|
| SM(d16:1/18:0) | ChEBI |
| sphingomyelin d16:1/18:0 | ChEBI |
| N-(octadecanoyl)hexadecasphing-4-enine-1-phosphocholine | ChEBI |
| Manual Xrefs | Databases |
|---|---|
| LMSP03010042 | LIPID MAPS |
| Registry Numbers | Sources |
|---|---|
| Reaxys:20856792 | Reaxys |