CHEBI:84318 - cholesteryl pentadecanoate

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ChEBI Name cholesteryl pentadecanoate
ChEBI ID CHEBI:84318
Definition A cholesterol ester obtained by the formal condensation of cholesterol with pentadecanoic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C42H74O2
Net Charge 0
Average Mass 611.03580
Monoisotopic Mass 610.56888
InChI InChI=1S/C42H74O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-22-40(43)44-35-27-29-41(5)34(31-35)23-24-36-38-26-25-37(33(4)21-19-20-32(2)3)42(38,6)30-28-39(36)41/h23,32-33,35-39H,7-22,24-31H2,1-6H3/t33-,35+,36+,37-,38+,39+,41+,42-/m1/s1
InChIKey BDBPUUADYAQHAV-VUFYKUQQSA-N
SMILES CCCCCCCCCCCCCCC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3CC=C2C1)[C@H](C)CCCC(C)C
Metabolite of Species Details
Mus musculus (NCBI:txid10090) See: MetaboLights Study
Roles Classification
Biological Role(s): mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing cholesteryl pentadecanoate (CHEBI:84318) has functional parent pentadecanoic acid (CHEBI:42504)
cholesteryl pentadecanoate (CHEBI:84318) has role mouse metabolite (CHEBI:75771)
cholesteryl pentadecanoate (CHEBI:84318) is a cholesteryl ester (CHEBI:17002)
IUPAC Name
(3β)-cholest-5-en-3-yl pentadecanoate
Synonyms Sources
15:0 cholesteryl ester HMDB
CE(15:0) LIPID MAPS
Manual Xref Database
LMST01020027 LIPID MAPS
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Registry Number Type Source
6546372 Reaxys Registry Number Reaxys
Last Modified
23 October 2015