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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:[(1R)-7-methoxy-2-methyl-1'-(4-methylphenyl)sulfonyl-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4'-piperidine]yl]methanol
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Accession:CHEBI:130023 term browser browse the term
Definition:A harmala alkaloid that has formula C25H31N3O4S.
Synonyms:related_synonym: Formula=C25H31N3O4S;   InChI=1S/C25H31N3O4S/c1-17-4-7-19(8-5-17)33(30,31)28-12-10-25(11-13-28)16-27(2)22(15-29)24-23(25)20-9-6-18(32-3)14-21(20)26-24/h4-9,14,22,26,29H,10-13,15-16H2,1-3H3/t22-/m0/s1;   InChIKey=IDTLSUBVBUIIPR-QFIPXVFZSA-N;   SMILES=CC1=CC=C(C=C1)S(=O)(=O)N2CCC3(CC2)CN([C@H](C4=C3C5=C(N4)C=C(C=C5)OC)CO)C
 xref: LINCS:LSM-41574



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Term Annotations click to browse term
  CHEBI ontology 19834
    role 19810
      biological role 19808
        biochemical role 19517
          metabolite 19504
            alkaloid 7816
              harmala alkaloid 72
                [(1R)-7-methoxy-2-methyl-1'-(4-methylphenyl)sulfonyl-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4'-piperidine]yl]methanol 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19834
    subatomic particle 19832
      composite particle 19832
        hadron 19832
          baryon 19832
            nucleon 19832
              atomic nucleus 19832
                atom 19832
                  main group element atom 19782
                    p-block element atom 19782
                      carbon group element atom 19730
                        carbon atom 19727
                          organic molecular entity 19727
                            organic molecule 19680
                              organic cyclic compound 19492
                                organic heterocyclic compound 18854
                                  organic heteropolycyclic compound 18284
                                    organic heterotricyclic compound 15640
                                      pyridoindole 136
                                        beta-carbolines 117
                                          harmala alkaloid 72
                                            [(1R)-7-methoxy-2-methyl-1'-(4-methylphenyl)sulfonyl-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4'-piperidine]yl]methanol 0
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