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: fumigaclavine C
Accession: CHEBI:64673
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Definition: An ergot alkaloid produced by the fungus Aspergillus fumigatus that is ergoline which is substituted by a 2-methylbut-3-en-2-yl group at position 2, methyl groups at the 6 and 8beta positions, and by an acetoxy group at the 9beta position.
Synonyms: exact_synonym: (8beta,9beta)-6,8-dimethyl-2-(2-methylbut-3-en-2-yl)ergolin-9-yl acetate
related_synonym: Formula=C23H30N2O2; InChI=1S/C23H30N2O2/c1-7-23(4,5)22-16-11-18-20(15-9-8-10-17(24-22)19(15)16)21(27-14(3)26)13(2)12-25(18)6/h7-10,13,18,20-21,24H,1,11-12H2,2-6H3/t13-,18+,20+,21-/m0/s1; InChIKey=OSICWVVWEXKSBD-LFAYTRTRSA-N; SMILES=[H][C@@]12Cc3c([nH]c4cccc(c34)[C@@]1([H])[C@@H](OC(C)=O)[C@@H](C)CN2C)C(C)(C)C=C
xref: CAS:62867-47-4
xref_mesh: MESH:C492995
xref: MetaCyc:CPD-12338; PMID:15231043; PMID:16023606; PMID:16397874; PMID:16557450; PMID:16902860; PMID:18678866; PMID:19256529; PMID:21762706; PMID:22344643; PMID:350117; Reaxys:19760287
cyclic_relationship: is_conjugate_base_of CHEBI:67147
G
Ifng
interferon gamma
decreases expression
ISO
fumigaclavine C results in decreased expression of IFNG mRNA; fumigaclavine C results in decreased expression of IFNG protein
CTD
PMID:16023606
NCBI chr 7:53,903,339...53,907,375
Ensembl chr 7:53,903,337...53,907,375
G
Il12a
interleukin 12A
decreases expression
ISO
fumigaclavine C results in decreased expression of IL12A mRNA
CTD
PMID:16023606
NCBI chr 2:152,965,769...152,973,035
Ensembl chr 2:152,965,769...152,972,734
G
Il1b
interleukin 1 beta
decreases expression
ISO
fumigaclavine C results in decreased expression of IL1B mRNA
CTD
PMID:16023606
NCBI chr 3:116,577,005...116,583,386
Ensembl chr 3:116,577,010...116,583,415
G
Il2
interleukin 2
decreases expression
ISO
fumigaclavine C results in decreased expression of IL2 mRNA; fumigaclavine C results in decreased expression of IL2 protein
CTD
PMID:16023606
NCBI chr 2:120,004,862...120,009,566
Ensembl chr 2:120,004,862...120,009,566
G
Mmp9
matrix metallopeptidase 9
decreases activity decreases expression
ISO
fumigaclavine C results in decreased activity of MMP9 protein fumigaclavine C results in decreased expression of MMP9 mRNA
CTD
PMID:16023606
NCBI chr 3:153,684,158...153,692,118
Ensembl chr 3:153,683,858...153,692,120
G
Tnf
tumor necrosis factor
decreases expression
ISO
fumigaclavine C results in decreased expression of TNF mRNA
CTD
PMID:16023606
NCBI chr20:3,622,011...3,624,629
Ensembl chr20:3,622,011...3,624,629
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