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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:anthramycin
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Accession:CHEBI:40699 term browser browse the term
Definition:A member of the class of pyrrolobenzodiazepines that is (11aS)-5,10,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepine substituted at positions 2, 5, 8, 9 and 11R by a (1E)-3-amino-3-oxoprop-1-en-1-yl, oxo, methyl, hydroxy and hydroxy groups, respectively. It is a natural product isolated from Streptomyces refuineus subsp. thermotolerans.
Synonyms:exact_synonym: (2E)-3-[(11R,11aS)-9,11-dihydroxy-8-methyl-5-oxo-5,10,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-2-yl]prop-2-enamide
 related_synonym: Formula=C16H17N3O4;   InChI=1S/C16H17N3O4/c1-8-2-4-10-13(14(8)21)18-15(22)11-6-9(3-5-12(17)20)7-19(11)16(10)23/h2-5,7,11,15,18,21-22H,6H2,1H3,(H2,17,20)/b5-3+/t11-,15+/m0/s1;   InChIKey=VGQOVCHZGQWAOI-YQRHFANHSA-N;   Ro 5-9000;   SMILES=[H][C@@]12CC(\\C=C\\C(N)=O)=CN1C(=O)C1=C(N[C@@H]2O)C(O)=C(C)C=C1;   antramicina;   antramycin;   antramycine;   antramycinum
 xref: CAS:4803-27-4;   KEGG:D02952;   MetaCyc:CPD-18441;   PDBeChem:ANT;   PMID:15599;   PMID:1695729;   PMID:17134232;   PMID:17584616;   PMID:18512205;   PMID:21919439;   PMID:2342065;   PMID:2620069;   PMID:2720404;   PMID:27862776;   PMID:28373034;   PMID:3210245;   PMID:354779;   PMID:3973905;   PMID:5647054;   PMID:582801;   PMID:6736032;   PMID:6928034;   PMID:7672363;   PMID:7947769;   PMID:8343501;   PMID:8357813;   Wikipedia:Anthramycin


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Path 1
Term Annotations click to browse term
  CHEBI ontology 26041
    role 25957
      biological role 25936
        poison 22509
          toxin 18390
            anthramycin 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 26041
    subatomic particle 26016
      composite particle 26016
        hadron 26016
          baryon 26016
            nucleon 26016
              atomic nucleus 26016
                atom 26016
                  main group element atom 25841
                    p-block element atom 25841
                      carbon group element atom 25441
                        carbon atom 25399
                          organic molecular entity 25399
                            heteroorganic entity 24773
                              organochalcogen compound 24384
                                organooxygen compound 24061
                                  carbon oxoacid 22757
                                    carboxylic acid 22737
                                      carboacyl group 20073
                                        univalent carboacyl group 20073
                                          carbamoyl group 19587
                                            carboxamide 19587
                                              alpha,beta-unsaturated carboxylic acid amide 7582
                                                enamide 7582
                                                  anthramycin 0
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