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CHEBI:137083 - 13-[(9Z)-octadecenoyloxy]octadecanoic acid
| Formula | C36H68O4 |
| Net Charge | 0 |
| Average Mass | 564.936 |
| Monoisotopic Mass | 564.51176 |
| SMILES | CCCCCCCC/C=C\CCCCCCCC(=O)OC(CCCCC)CCCCCCCCCCCC(=O)O |
| InChI | InChI=1S/C36H68O4/c1-3-5-7-8-9-10-11-12-13-14-15-19-22-25-29-33-36(39)40-34(30-26-6-4-2)31-27-23-20-17-16-18-21-24-28-32-35(37)38/h12-13,34H,3-11,14-33H2,1-2H3,(H,37,38)/b13-12- |
| InChIKey | RCTXOTTXFKSGGU-SEYXRHQNSA-N |
| Roles Classification |
|---|
| Chemical Role: | Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 13-[(9Z)-octadecenoyloxy]octadecanoic acid (CHEBI:137083) has functional parent 13-hydroxyoctadecanoic acid (CHEBI:136406) |
| 13-[(9Z)-octadecenoyloxy]octadecanoic acid (CHEBI:137083) has functional parent oleic acid (CHEBI:16196) |
| 13-[(9Z)-octadecenoyloxy]octadecanoic acid (CHEBI:137083) is a fatty acid ester (CHEBI:35748) |
| 13-[(9Z)-octadecenoyloxy]octadecanoic acid (CHEBI:137083) is a monocarboxylic acid (CHEBI:25384) |
| 13-[(9Z)-octadecenoyloxy]octadecanoic acid (CHEBI:137083) is conjugate acid of 13-[(9Z)-octadecenoyloxy]octadecanoate (CHEBI:136303) |
| Incoming Relation(s) |
| 13-[(9Z)-octadecenoyloxy]octadecanoate (CHEBI:136303) is conjugate base of 13-[(9Z)-octadecenoyloxy]octadecanoic acid (CHEBI:137083) |
| IUPAC Name |
|---|
| 13-{[(9Z)-octadec-9-enoyl]oxy}octadecanoic acid |
| Synonyms | Source |
|---|---|
| oleoyl-13-hydroxystearate ester | ChEBI |
| 13-(oleoyloxy)stearic acid | ChEBI |
| 13-(9Z-octadecenoyloxy)-octadecanoic acid | LIPID MAPS |
| FAHFA(18:1(9Z)/13-O-18:0) | LIPID MAPS |
| 13-OAHSA | LIPID MAPS |
| Manual Xrefs | Databases |
|---|---|
| LMFA07011065 | LIPID MAPS |
| Citations |
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