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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:8-demethyl-8-D-glucosyltetracenomycin C
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Accession:CHEBI:219065 term browser browse the term
Synonyms:exact_synonym: methyl (6aR,7S,10aR)-6a,7,10a,12-tetrahydroxy-8-methoxy-1-methyl-6,10,11-trioxo-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-7H-tetracene-2-carboxylate
 related_synonym: Formula=C28H28O16;   InChI=1S/C28H28O16/c1-8-15-9(5-11(16(8)25(38)42-3)43-26-21(34)20(33)18(31)13(7-29)44-26)4-10-17(19(15)32)24(37)27(39)14(30)6-12(41-2)23(36)28(27,40)22(10)35/h4-6,13,18,20-21,23,26,29,31-34,36,39-40H,7H2,1-3H3/t13-,18-,20+,21-,23-,26-,27-,28-/m1/s1;   InChIKey=KFCYCGQFYQCWHV-KZHGEDNHSA-N;   SMILES=O=C1C2=C(O)C=3C(=CC(O[C@@H]4O[C@@H]([C@@H](O)[C@@H]([C@H]4O)O)CO)=C(C3C)C(=O)OC)C=C2C(=O)[C@@]5([C@@]1(O)C(=O)C=C(OC)[C@H]5O)O
 xref: Chemspider:10232959


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Path 1
Term Annotations click to browse term
  CHEBI ontology 0
    chemical entity 0
      group 0
        inorganic group 0
          oxo group 0
            organic oxo compound 0
              carbonyl compound 0
                ketone 0
                  cyclic ketone 0
                    quinone 0
                      8-demethyl-8-D-glucosyltetracenomycin C 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    p-block element atom 0
                      carbon group element atom 0
                        carbon atom 0
                          organic molecular entity 0
                            heteroorganic entity 0
                              organochalcogen compound 0
                                organooxygen compound 0
                                  carbonyl compound 0
                                    ketone 0
                                      cyclic ketone 0
                                        quinone 0
                                          8-demethyl-8-D-glucosyltetracenomycin C 0
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