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: 6,9-difluoro-11-hydroxy-17-(3-hydroxy-2-oxopropyl)-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthrene-17-carbothioic acid S-(fluoromethyl) ester
Accession: CHEBI:91778
browse the term
Definition: A 3-hydroxy steroid that has formula C25H31F3O5S.
Synonyms: related_synonym: Formula=C25H31F3O5S; InChI=1S/C25H31F3O5S/c1-13-6-16-17-8-19(27)18-7-14(30)4-5-22(18,2)25(17,28)20(32)10-23(16,3)24(13,9-15(31)11-29)21(33)34-12-26/h4-5,7,13,16-17,19-20,29,32H,6,8-12H2,1-3H3; InChIKey=RZXNVYCLMORIIB-UHFFFAOYSA-N; SMILES=CC1CC2C3CC(C4=CC(=O)C=CC4(C3(C(CC2(C1(CC(=O)CO)C(=O)SCF)C)O)F)C)F
xref: LINCS:LSM-1668
Term paths to the root one shortest all shortest one longest all longest one shortest and longest all
Path 1
CHEBI ontology
19834
role
19810
biological role
19808
molecular messenger
18637
hormone
18484
sex hormone
18305
androgen
5678
6,9-difluoro-11-hydroxy-17-(3-hydroxy-2-oxopropyl)-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthrene-17-carbothioic acid S-(fluoromethyl) ester
0
Path 2
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 polycyclic compound
17240
steroid
14686
hydroxy steroid
14430
3-hydroxy steroid
12768
6,9-difluoro-11-hydroxy-17-(3-hydroxy-2-oxopropyl)-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthrene-17-carbothioic acid S-(fluoromethyl) ester
0