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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:Cervimycin B
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Accession:CHEBI:206185 term browser browse the term
Synonyms:exact_synonym: 3-[(2S,3S,6S)-6-[(2S,3S,6S)-6-[(2S,3S,6S)-6-[(2R,3S,6S)-6-[[(1R,4aS,12aR)-3-acetyl-4,6-dihydroxy-4a-[(2S,5S,6R)-5-[(2S,5S,6R)-5-hydroxy-6-methyloxan-2-yl]oxy-6-methyloxan-2-yl]oxy-9-methoxy-2,5,7,10-tetraoxo-12,12a-dihydro-1H-tetracen-1-yl]oxy]-2-methyloxan-3-yl]oxy-2-methyloxan-3-yl]oxy-2-methyloxan-3-yl]oxy-2-methyloxan-3-yl]oxy-2-methyl-3-oxopropanoic acid
 related_synonym: Formula=C61H80O25;   InChI=1S/C61H80O25/c1-25(59(70)71)60(72)84-42-14-19-47(77-32(42)8)82-39-12-17-45(75-29(39)5)81-38-11-18-46(76-28(38)4)83-40-13-20-48(78-30(40)6)85-56-35-23-33-22-34-52(37(64)24-43(73-9)53(34)65)54(66)51(33)58(69)61(35,57(68)50(26(2)62)55(56)67)86-49-21-15-41(31(7)79-49)80-44-16-10-36(63)27(3)74-44/h22,24-25,27-32,35-36,38-42,44-49,56,63,66,68H,10-21,23H2,1-9H3,(H,70,71)/t25?,27-,28+,29+,30-,31-,32+,35-,36+,38+,39+,40+,41+,42+,44+,45+,46+,47+,48+,49+,56-,61+/m1/s1;   InChIKey=BWIAPPHQSUHPDB-IWCGXAMISA-N;   SMILES=O=C1C(OC)=CC(=O)C2=C1C=C3C[C@@H]4[C@@H](O[C@@H]5O[C@@H]([C@@H](O[C@@H]6O[C@H]([C@@H](O[C@@H]7O[C@H]([C@@H](O[C@@H]8O[C@H]([C@@H](OC(=O)C(C(=O)O)C)CC8)C)CC7)C)CC6)C)CC5)C)C(=O)C(=C([C@@]4(C(C3=C2O)=O)O[C@@H]9O[C@@H]([C@@H](O[C@@H]%10O[C@@H]([C@@H](O)CC%10)C)CC9)C)O)C(=O)C
 xref: Chemspider:9868547


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Term Annotations click to browse term
  CHEBI ontology 26447
    chemical entity 26427
      atom 26423
        nonmetal atom 25687
          oxygen atom 24884
            oxygen molecular entity 24884
              organooxygen compound 24143
                carbohydrates and carbohydrate derivatives 16806
                  carbohydrate derivative 15672
                    glycosyl compound 13740
                      glycoside 12301
                        Cervimycin B 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 26447
    subatomic particle 26423
      composite particle 26423
        hadron 26423
          baryon 26423
            nucleon 26423
              atomic nucleus 26423
                atom 26423
                  main group element atom 26169
                    p-block element atom 26169
                      carbon group element atom 25605
                        carbon atom 25568
                          organic molecular entity 25568
                            heteroorganic entity 24958
                              organochalcogen compound 24553
                                organooxygen compound 24143
                                  carbonyl compound 23616
                                    ketone 19366
                                      cyclic ketone 16864
                                        quinone 9225
                                          acenoquinone 8224
                                            anthraquinone 537
                                              Cervimycin B 0
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