Number |
qtl-m0047 |
Declustering Potential(DP) |
10 |
Collision Energy(CE) |
30 |
Observed mass(Da) |
246.2427 |
Exact mass(Da) |
246.2428 |
Accurate mass error(ppm) |
0.24 |
Molecular formula |
C14H28O2 |
Ionization model |
NH4+ |
Ret. Time(min) |
|
Precursor ions(Q1) |
246.1 |
Product ions(Q3) |
198.2 |
Main fragments |
198.2 |
Compound |
Myristic acid |
Identification |
putative |
class |
Organic acid |
Organism |
|
Reference |
Chen et. al (2009) |
CV(%) |
|
H2 |
|
ChEBI_ID |
CHEBI:28875 |
Agricola Citation Links |
|
ArrayExpress Database Links |
|
BRAND Names |
|
Beilstein Registry Numbers |
508624;; |
BioModels Database Links |
|
CAS Registry Numbers |
544-63-8;; |
COMe Database Links |
|
ChEBI ID |
|
ChEBI Name |
tetradecanoic acid;; |
Charge |
0;; |
Chinese Abstracts Citation Links |
|
CiteXplore Citation Links |
|
Definition |
A straight-chain, fourteen-carbon, long-chain saturated fatty acid mostly found in milk fat.;; |
DrugBank Database Links |
DB08231;; |
Formulae |
C14H28O2;; |
Gmelin Registry Numbers |
242115;; |
INN |
|
IUPAC Names |
myristic acid;; |
InChI |
InChI=1S/C14H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h2-13H2,1H3,(H,15,16);; |
InChIKey |
TUNFSRHWOTWDNC-UHFFFAOYSA-N;; |
IntAct Database Links |
|
IntEnz Database Links |
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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 |
|
LIPID MAPS instance Database Links |
|
Last Modified |
29 Jun 2016;; |
Mass |
228.37090;; |
MolBase Database Links |
|
PDBeChem Database Links |
|
Patent Database Links |
WO2007130882;;WO2007124465;;WO2007122619;;WO2007109802;;WO2007109801;;WO2007098479;;WO2007094000;;WO2007089337;;WO2006083130;;WO2006050002;;WO2006047888;;US2008269184;;US2008226710;;US2008176956;;US2008153899;;US2008090803;;US2008044475;;US2008004342;;US2 |
PubChem Database Links |
8144261;; |
PubMed Central Citation Links |
|
PubMed Citation Links |
9794112;;8412012;;347849;;2810891;;24421258;;23940645;;22030224;;21955528;;20920594;;20634506;;19955401;;19902021;;19786012;;19761868;;19212411;;19154695;;15970594;;15936650;;15898737;;15770953;;15661480;;13129458;;12829005;;11124748;;11059101;;10570241;; |
RESID Database Links |
|
Reactome Database Links |
R-HSA-879585;;R-HSA-5627891;;R-HSA-444191;;R-HSA-383313;; |
Rhea Database Links |
|
SABIO-RK Database Links |
793;;6799;;6583;;13799;;12133;;11933;;11930;;11166;;10952;;10945;;10187;; |
SMILES |
CCCCCCCCCCCCCC(O)=O;; |
Secondary ChEBI ID |
CHEBI:7056;;CHEBI:26897;;CHEBI:73168;;CHEBI:44232;;CHEBI:278516;; |
Star |
3;; |
Synonyms |
tetradecoic acid;;tetradecanoic acid;;n-tetradecanoic acid;;n-Tetradecoic acid;;n-Tetradecan-1-oic acid;;acide tetradecanoique;;Tetradecanoic (Myristic) acid;;N-Tetradecanoate;;N-Tetradecan-1-oate;;Myristoic acid;;Myristoate;;Myristinsaeure;;Myristic acid |
UM-BBD compID Database Links |
|
UniProt Database Links |
Q9Z1R3;;Q9UMR5;;Q9GKX2;;Q9BTZ2;;Q99LB2;;Q96T53;;Q8WNV7;;Q8VID1;;Q8SPU8;;Q8ISS3;;Q8BGN3;;Q7XJJ7;;Q6ZWL3;;Q6UWR7;;Q6PCJ9;;Q6GNY7;;Q64727;;Q5RCF8;;Q5RB45;;Q5R894;;Q58D68;;Q39473;;Q2LE37;;Q1JQA0;;Q04615;;P85972;;P78615;;P53554;;P39540;;P29334;;P26234;;P24272; |
ChEBI Image |
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