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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:(2R,3R)-1-(2,3-dihydro-1H-inden-2-yl)-2-[4-(hydroxymethyl)-2-iodophenyl]-3-[(4-methylphenyl)thio]-5-oxo-N-propan-2-yl-3-pyrrolidinecarboxamide
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Accession:CHEBI:125283 term browser browse the term
Definition:A pyrrolidine that has formula C31H33IN2O3S.
Synonyms:related_synonym: Formula=C31H33IN2O3S;   InChI=1S/C31H33IN2O3S/c1-19(2)33-30(37)31(38-25-11-8-20(3)9-12-25)17-28(36)34(24-15-22-6-4-5-7-23(22)16-24)29(31)26-13-10-21(18-35)14-27(26)32/h4-14,19,24,29,35H,15-18H2,1-3H3,(H,33,37)/t29-,31-/m1/s1;   InChIKey=XIEZTGHUGZSGMS-BVRKHOPBSA-N;   SMILES=CC1=CC=C(C=C1)S[C@@]2(CC(=O)N([C@@H]2C3=C(C=C(C=C3)CO)I)C4CC5=CC=CC=C5C4)C(=O)NC(C)C
 xref: LINCS:LSM-36754


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  CHEBI ontology 0
    chemical entity 0
      atom 0
        nonmetal atom 0
          nitrogen atom 0
            nitrogen molecular entity 0
              organonitrogen compound 0
                organonitrogen heterocyclic compound 0
                  pyrrolidines 0
                    (2R,3R)-1-(2,3-dihydro-1H-inden-2-yl)-2-[4-(hydroxymethyl)-2-iodophenyl]-3-[(4-methylphenyl)thio]-5-oxo-N-propan-2-yl-3-pyrrolidinecarboxamide 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
                            organic molecule 0
                              organic cyclic compound 0
                                organic heterocyclic compound 0
                                  organic heteromonocyclic compound 0
                                    pyrrolidines 0
                                      (2R,3R)-1-(2,3-dihydro-1H-inden-2-yl)-2-[4-(hydroxymethyl)-2-iodophenyl]-3-[(4-methylphenyl)thio]-5-oxo-N-propan-2-yl-3-pyrrolidinecarboxamide 0
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