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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:asukamycin
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Accession:CHEBI:73481 term browser browse the term
Definition:A polyketide that is a member of the manumycin family of antibiotics and exhibits strong antibacterial, antifungal, and antineoplastic activities. Isolated from from the actinomycete bacterium Streptomyces nodosus subsp. asukaensis.
Synonyms:exact_synonym: (2E,4E,6E)-7-cyclohexyl-N-[(1S,5S,6R)-5-hydroxy-5-{(1E,3E,5E)-7-[(2-hydroxy-5-oxocyclopent-1-en-1-yl)amino]-7-oxohepta-1,3,5-trien-1-yl}-2-oxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl]hepta-2,4,6-trienamide
 related_synonym: AM 1042;   Formula=C31H34N2O7;   InChI=1S/C31H34N2O7/c34-23-17-18-24(35)27(23)33-26(37)16-10-3-4-11-19-31(39)20-22(28(38)29-30(31)40-29)32-25(36)15-9-2-1-6-12-21-13-7-5-8-14-21/h1-4,6,9-12,15-16,19-21,29-30,34,39H,5,7-8,13-14,17-18H2,(H,32,36)(H,33,37)/b2-1+,4-3+,12-6+,15-9+,16-10+,19-11+/t29-,30-,31+/m1/s1;   InChIKey=SSHVAUUEPNULMP-JHWDTTIQSA-N;   SMILES=OC1=C(NC(=O)\\C=C\\C=C\\C=C\\[C@]2(O)C=C(NC(=O)\\C=C\\C=C\\C=C\\C3CCCCC3)C(=O)[C@H]3O[C@@H]23)C(=O)CC1;   asukamycin A1
 alt_id: CHEBI:29521
 xref: Beilstein:3639742;   CAS:61116-33-4;   KEGG:C12099;   KNApSAcK:C00018105;   PMCID:PMC3513075;   PMID:15038738;   PMID:16816183;   PMID:19787206;   PMID:20522559;   PMID:21854515;   PMID:22555913;   PMID:3553432;   PMID:993129;   Patent:US4226879;   Reaxys:6674537

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  CHEBI ontology 0
    role 0
      biological role 0
        antimicrobial agent 0
          asukamycin 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
                                  carbon oxoacid 0
                                    carboxylic acid 0
                                      carboacyl group 0
                                        univalent carboacyl group 0
                                          carbamoyl group 0
                                            carboxamide 0
                                              alpha,beta-unsaturated carboxylic acid amide 0
                                                enamide 0
                                                  protoasukamycin 0
                                                    4-hydroxyprotoasukamycin 0
                                                      asukamycin 0
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