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: (1S,5aR,9bR)-9b-fluoro-1-hydroxy-1,9a,11a-trimethyl-2H,3H,3aH,3bH,4H,5H,5aH,6H,8H,9H-cyclopenta[a]phenanthren-7-one
Accession: CHEBI:143318
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Synonyms: related_synonym: Formula=C20H29FO2; InChI=1S/C20H29FO2/c1-17-8-6-14(22)12-13(17)4-5-16-15-7-9-19(3,23)18(15,2)10-11-20(16,17)21/h10-11,13,15-16,23H,4-9,12H2,1-3H3/t13-,15?,16?,17?,18?,19+,20-/m0/s1; InChIKey=MUHWBWWNVRTUFW-KDIDWSFYSA-N; SMILES=F[C@@]12C=CC3([C@@](O)(C)CCC3C1CC[C@@H]4C2(CCC(C4)=O)C)C
Term paths to the root one shortest all shortest one longest all longest one shortest and longest all
Path 1
CHEBI ontology
19811
chemical entity
19840
atom
19809
nonmetal atom
19747
halogen
18659
halogen molecular entity
18659
fluorine molecular entity
14971
organofluorine compound
14645
fluorinated steroid
5149
(1S,5aR,9bR)-9b-fluoro-1-hydroxy-1,9a,11a-trimethyl-2H,3H,3aH,3bH,4H,5H,5aH,6H,8H,9H-cyclopenta[a]phenanthren-7-one
0
Path 2
CHEBI ontology
19811
subatomic particle
19809
composite particle
19809
hadron
19840
baryon
19809
nucleon
19809
atomic nucleus
19809
atom
19809
main group element atom
19759
p-block element atom
19759
carbon group element atom
19708
carbon atom
19734
organic molecular entity
19705
organic molecule
19658
organic cyclic compound
19471
organic polycyclic compound
17244
steroid
14672
fluorinated steroid
5149
(1S,5aR,9bR)-9b-fluoro-1-hydroxy-1,9a,11a-trimethyl-2H,3H,3aH,3bH,4H,5H,5aH,6H,8H,9H-cyclopenta[a]phenanthren-7-one
0