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CHEBI ONTOLOGY - ANNOTATIONS

The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at http://www.ebi.ac.uk/chebi/. The data is made available under the Creative Commons License (CC BY 3.0, http://creativecommons.org/licenses/by/3.0/). For more information see: Degtyarenko et al. (2008) ChEBI: a database and ontology for chemical entities of biological interest. Nucleic Acids Res. 36, D344–D350.

Term:cholesteryl hemisuccinate
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Accession:CHEBI:138742 term browser browse the term
Definition:A dicarboxylic acid monoester resulting from the formal condensation of the hydroxy group of cholesterol with one of the carboxy groups of succinic acid. A detergent that is often used to replace cholesterol in protein crystallography, biochemical studies of proteins, and pharmacology.
Synonyms:exact_synonym: 4-[(3beta)-cholest-5-en-3-yloxy]-4-oxobutanoic acid
 related_synonym: 3beta-hydroxy-5-cholestene 3-hemisuccinate;   4-[[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-4-oxobutanoic acid;   Formula=C31H50O4;   InChI=1S/C31H50O4/c1-20(2)7-6-8-21(3)25-11-12-26-24-10-9-22-19-23(35-29(34)14-13-28(32)33)15-17-30(22,4)27(24)16-18-31(25,26)5/h9,20-21,23-27H,6-8,10-19H2,1-5H3,(H,32,33)/t21-,23+,24+,25-,26+,27+,30+,31-/m1/s1;   InChIKey=WLNARFZDISHUGS-MIXBDBMTSA-N;   SMILES=C1[C@@]2([C@]3(CC[C@]4([C@]([C@@]3(CC=C2C[C@H](C1)OC(=O)CCC(O)=O)[H])(CC[C@@]4([C@H](C)CCCC(C)C)[H])[H])C)[H])C;   cholest-5-en-3beta-yl hydrogen succinate;   cholesteryl succinate
 xref: CAS:1510-21-0;   PDBeChem:Y01;   PMID:18302031;   PMID:24526383;   PMID:25450348;   PMID:9067481;   PMID:9858729;   Reaxys:3181155



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Term Annotations click to browse term
  CHEBI ontology 19911
    role 19887
      application 19723
        detergent 3645
          cholesteryl hemisuccinate 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19911
    subatomic particle 19909
      composite particle 19909
        hadron 19909
          baryon 19909
            nucleon 19909
              atomic nucleus 19909
                atom 19909
                  main group element atom 19859
                    p-block element atom 19859
                      carbon group element atom 19803
                        carbon atom 19799
                          organic molecular entity 19799
                            organic group 18986
                              organic divalent group 18961
                                organodiyl group 18961
                                  carbonyl group 18917
                                    carbonyl compound 18917
                                      dicarboxylic acids and O-substituted derivatives 10609
                                        dicarboxylic acid 10601
                                          alpha,omega-dicarboxylic acid 3138
                                            succinic acid 653
                                              succinate ester 125
                                                hemisuccinate 121
                                                  cholesteryl hemisuccinate 0
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