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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:Aldgamycin P
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Accession:CHEBI:220978 term browser browse the term
Synonyms:exact_synonym: (1S,3R,6E,8S,10S,12S,16S)-12-hydroxy-2-[[(2R,3R,4R,5R,6R)-5-hydroxy-3,4-dimethoxy-6-methyloxan-2-yl]oxymethyl]-9-[[(4S,5R,6R,7S,9R)-6-hydroxy-4,9-dimethyl-2-oxo-1,3,8-trioxaspiro[4.5]decan-7-yl]oxy]-3,8,10,12-tetramethyl-4,17-dioxabicyclo[14.1.0]heptadec-6-ene-5,13-dione
 related_synonym: Formula=C37H58O16;   InChI=1S/C37H58O16/c1-17-10-13-26(39)48-20(4)23(16-46-33-31(45-9)30(44-8)27(40)21(5)49-33)29-24(51-29)11-12-25(38)36(7,43)14-18(2)28(17)52-34-32(41)37(15-19(3)47-34)22(6)50-35(42)53-37/h10,13,17-24,27-34,40-41,43H,11-12,14-16H2,1-9H3/b13-10+/t17-,18-,19+,20+,21+,22-,23?,24-,27+,28?,29-,30+,31+,32-,33+,34-,36-,37-/m0/s1;   InChIKey=UPLGFIAZLRKBJD-ZFVCAGSTSA-N;   SMILES=O=C1O[C@@H](C([C@@H]2O[C@H]2CCC(=O)[C@](C[C@@H](C([C@H](C=C1)C)O[C@@H]3O[C@@H](C[C@]4([C@H]3O)OC(=O)O[C@H]4C)C)C)(O)C)CO[C@@H]5O[C@@H]([C@@H](O)[C@H]([C@H]5OC)OC)C)C

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  CHEBI ontology 0
    chemical entity 0
      atom 0
        nonmetal atom 0
          oxygen atom 0
            oxygen molecular entity 0
              organooxygen compound 0
                polyketide 0
                  macrolide 0
                    Aldgamycin P 0
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  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
                                  ester 0
                                    carboxylic ester 0
                                      lactone 0
                                        macrocyclic lactone 0
                                          macrolide 0
                                            Aldgamycin P 0
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