EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C39H72O5 |
| Net Charge | 0 |
| Average Mass | 621.000 |
| Monoisotopic Mass | 620.53798 |
| SMILES | CCCCCCCC/C=C\CCCCCCCC(=O)OCC(O)COC(=O)CCCCCCC/C=C\CCCCCCCC |
| InChI | InChI=1S/C39H72O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(41)43-35-37(40)36-44-39(42)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17-20,37,40H,3-16,21-36H2,1-2H3/b19-17-,20-18- |
| InChIKey | DRAWQKGUORNASA-CLFAGFIQSA-N |
| Roles Classification |
|---|
| Biological Roles: | Papio hamadryas metabolite Any mammalian metabolite produced during a metabolic reaction in Papio hamadryas. human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). Saccharomyces cerevisiae metabolite Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ). human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). Saccharomyces cerevisiae metabolite Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1,3-dioleoylglycerol (CHEBI:75735) has functional parent oleic acid (CHEBI:16196) |
| 1,3-dioleoylglycerol (CHEBI:75735) is a 1,3-diglyceride (CHEBI:47777) |
| 1,3-dioleoylglycerol (CHEBI:75735) is a diacylglycerol (18:1/0:0/18:1) (CHEBI:134567) |
| 1,3-dioleoylglycerol (CHEBI:75735) is a dioleoylglycerol (CHEBI:75945) |
| IUPAC Name |
|---|
| 2-hydroxypropane-1,3-diyl (9Z,9'Z)bis-octadec-9-enoate |
| Synonyms | Source |
|---|---|
| 1,3-Diolein | ChemIDplus |
| 2-Hydroxy-1,3-propanediyl dioleate | ChemIDplus |
| DAG(18:1/0:0/18:1) | HMDB |
| DAG(18:1ω9/0:0/18:1ω9) | HMDB |
| DAG(36:2) | HMDB |
| DG(18:1/0:0/18:1) | HMDB |
| UniProt Name | Source |
|---|---|
| 1,3-di-(9Z-octadecenoyl)-glycerol | UniProt |
| Manual Xrefs | Databases |
|---|---|
| HMDB0056197 | HMDB |
| Registry Numbers | Sources |
|---|---|
| Reaxys:1730341 | Reaxys |
| CAS:2465-32-9 | ChemIDplus |