| Number |
qtl-m0399 |
| Declustering Potential(DP) |
60 |
| Collision Energy(CE) |
40 |
| Observed mass(Da) |
402.3938 |
| Exact mass(Da) |
402.3942 |
| Accurate mass error(ppm) |
0.97 |
| Molecular formula |
C24H48O3 |
| Ionization model |
NH4+ |
| Ret. Time(min) |
|
| Precursor ions(Q1) |
402.4 |
| Product ions(Q3) |
340.4 |
| Main fragments |
340.4, 384.5, 296.3, 102.1, 88.1 |
| Compound |
24-Hydroxytetracosanoic acid |
| Identification |
putative |
| class |
Fatty acid |
| Organism |
|
| Reference |
Molina et. al (2006) |
| CV(%) |
|
| H2 |
|
| ChEBI_ID |
CHEBI:76930 |
| Agricola Citation Links |
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| ArrayExpress Database Links |
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| BRAND Names |
|
| Beilstein Registry Numbers |
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| BioModels Database Links |
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| CAS Registry Numbers |
|
| COMe Database Links |
|
| ChEBI ID |
|
| ChEBI Name |
omega-hydroxytetracosanoic acid;; |
| Charge |
0;; |
| Chinese Abstracts Citation Links |
|
| CiteXplore Citation Links |
|
| Definition |
An omega-hydroxy fatty acid that is the 24-hydroxy derivative of tetracosanoic acid.;; |
| DrugBank Database Links |
|
| Formulae |
C24H48O3;; |
| Gmelin Registry Numbers |
|
| INN |
|
| IUPAC Names |
24-hydroxytetracosanoic acid;; |
| InChI |
InChI=1S/C24H48O3/c25-23-21-19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18-20-22-24(26)27/h25H,1-23H2,(H,26,27);; |
| InChIKey |
OVBKVWSHXDCSTK-UHFFFAOYSA-N;; |
| IntAct Database Links |
|
| IntEnz Database Links |
|
| KEGG COMPOUND Database Links |
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| KEGG DRUG Database Links |
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| KEGG GLYCAN Database Links |
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| LIPID MAPS class Database Links |
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| LIPID MAPS instance Database Links |
|
| Last Modified |
14 Jul 2014;; |
| Mass |
384.63610;; |
| MolBase Database Links |
|
| PDBeChem Database Links |
|
| Patent Database Links |
|
| PubChem Database Links |
172121003;; |
| PubMed Central Citation Links |
|
| PubMed Citation Links |
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| RESID Database Links |
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| Reactome Database Links |
|
| Rhea Database Links |
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| SABIO-RK Database Links |
|
| SMILES |
OCCCCCCCCCCCCCCCCCCCCCCCC(O)=O;; |
| Secondary ChEBI ID |
|
| Star |
3;; |
| Synonyms |
omega-hydroxylignoceric acid;;24-hydroxylignoceric acid;; |
| UM-BBD compID Database Links |
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| UniProt Database Links |
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| ChEBI Image |
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