OntologieschebiclassesCHEBI:84326   
JSON document
cholesteryl heptadecanoate
http://purl.obolibrary.org/obo/CHEBI_84326

A cholesterol ester obtained by the formal condensation of cholesterol with margaric acid.

Also appears inslm
Exact Synonyms
(3beta)-cholest-5-en-3-yl heptadecanoate
Related Synonyms
17:0 Cholesteryl ester
CE(17:0)
class Information
charge

0

formula

C44H78O2

has_obo_namespace

chebi_ontology

inchi

InChI=1S/C44H78O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-42(45)46-37-29-31-43(5)36(33-37)25-26-38-40-28-27-39(35(4)23-21-22-34(2)3)44(40,6)32-30-41(38)43/h25,34-35,37-41H,7-24,26-33H2,1-6H3/t35-,37+,38+,39-,40+,41+,43+,44-/m1/s1

inchikey

PPQNZVDOBYGOLY-BFGJSWSOSA-N

in_subset

3_STAR

mass

639.08890

monoisotopicmass

638.60018

smiles

CCCCCCCCCCCCCCCCC(=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

class Relations