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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:1'-hydroxy-demethylspheroidene
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Accession:CHEBI:143013 term browser browse the term
Definition:A carotenol obtained by formal hydration of a double bond at position 1' of demethylspheroidene.
Synonyms:exact_synonym: (3E)-3,4-didehydro-1,1',2,2',7',8'-hexahydro-psi,psi-carotene-1,1'-diol
 related_synonym: 1'-hydroxydemethylspheroidene;   1,1'-dihydroxy-demethylspheroidene;   1-OH-DMS;   1-OH-demethylspheroidene;   Formula=C40H60O2;   InChI=1S/C40H60O2/c1-33(21-13-23-35(3)25-15-27-37(5)29-17-31-39(7,8)41)19-11-12-20-34(2)22-14-24-36(4)26-16-28-38(6)30-18-32-40(9,10)42/h11-15,17,19-25,27-29,41-42H,16,18,26,30-32H2,1-10H3/b12-11+,21-13+,22-14+,25-15+,29-17+,33-19+,34-20+,35-23+,36-24+,37-27+,38-28+;   InChIKey=QWBRVLJPJJNHCQ-SDTALWBMSA-N;   SMILES=C(\\C=C\\C=C(\\C=C\\CC(C)(C)O)/C)(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/CC/C=C(/CCCC(C)(C)O)\\C)\\C)\\C)/C)/C
 xref: LIPID_MAPS_instance:LMPR01070213;   PMID:15251462



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Path 1
Term Annotations click to browse term
  CHEBI ontology 19904
    chemical entity 19902
      molecular entity 19901
        polyatomic entity 19852
          heteroatomic molecular entity 19809
            hydroxides 19377
              organic hydroxy compound 18984
                polyol 11718
                  diol 3955
                    1'-hydroxy-demethylspheroidene 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19904
    subatomic particle 19902
      composite particle 19902
        hadron 19902
          baryon 19902
            nucleon 19902
              atomic nucleus 19902
                atom 19902
                  main group element atom 19841
                    main group molecular entity 19841
                      s-block molecular entity 19675
                        hydrogen molecular entity 19657
                          hydrides 19165
                            organic hydride 18712
                              organic fundamental parent 18712
                                hydrocarbon 18462
                                  terpene 14082
                                    tetraterpene 611
                                      carotene 611
                                        carotenoid 611
                                          xanthophyll 275
                                            carotenol 241
                                              demethylspheroidene 0
                                                1'-hydroxy-demethylspheroidene 0
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