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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:Cerinolactone
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Accession:CHEBI:222038 term browser browse the term
Synonyms:exact_synonym: (3R,5S)-5-[(4aS,6R,8aR)-3-methylidene-6-propan-2-yl-4a,5,6,7,8,8a-hexahydro-4H-naphthalen-2-yl]-3-hydroxyoxolan-2-one
 related_synonym: Formula=C18H26O3;   InChI=1S/C18H26O3/c1-10(2)12-4-5-13-8-15(11(3)6-14(13)7-12)17-9-16(19)18(20)21-17/h8,10,12-14,16-17,19H,3-7,9H2,1-2H3/t12-,13+,14-,16-,17+/m1/s1;   InChIKey=XGQCVHNPQMRYDI-QZCUMHFISA-N;   SMILES=O=C1O[C@H](C=2C(=C)C[C@@H]3C[C@H](C(C)C)CC[C@H]3C2)C[C@H]1O
 xref: Chemspider:28289593


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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 499
    chemical entity 499
      group 493
        inorganic group 442
          oxo group 404
            organic oxo compound 404
              carbonyl compound 404
                carboxylic ester 102
                  lactone 43
                    gamma-lactone 19
                      Cerinolactone 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 499
    subatomic particle 499
      composite particle 499
        hadron 499
          baryon 499
            nucleon 499
              atomic nucleus 499
                atom 499
                  main group element atom 492
                    p-block element atom 492
                      carbon group element atom 481
                        carbon atom 480
                          organic molecular entity 480
                            heteroorganic entity 476
                              organochalcogen compound 430
                                organooxygen compound 428
                                  ester 108
                                    carboxylic ester 102
                                      lactone 43
                                        gamma-lactone 19
                                          Cerinolactone 0
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