Closed paola-scibite closed 1 year ago
@amalik01 Hi, it was a pleasure to meet you at the Biocuration conference! With regards to our conversation of where ChEBI curation might have the most impact, compatibly with resources, I've reviewed my open tickets. At present, if possible, I'd prioritise the 5 apparent duplications above, please. They might not be duplications after all, but that's where I'd need your feedback please. Thank you in advance! Paola
Hi @paola-scibite. It was nice meeting you too. I have fixed the above 5 entries. The 1st pair were tautomers and now clearly differentiated. The 2nd and 3rd pairs were duplicates and have now been merged. The 4th pair (one of the compounds was specific compound whereas the other was a class of compounds). The 5th pair were supposed to be two different compounds.
Thanks
Hi, I noticed 5 pairs of these please, where the IUPAC name of the former is exactly the same as the label of the latter. Should one of the two be revised please? Thanks.
1st pair:
CHEBI:183430 - 5-acetyl-2,6-dimethyl-1,2,3,4-tetrahydropyridin-4-one IUPAC Name: 5-acetyl-2,6-dimethyl-2,3-dihydro-1H-pyridin-4-one
CHEBI:181997 - 5-acetyl-2,6-dimethyl-2,3-dihydro-1H-pyridin-4-one IUPAC Name: 1-(4-hydroxy-2,6-dimethyl-2,3-dihydropyridin-5-yl)ethanone
2nd pair:
CHEBI:179636 - 5-ethyl-5-methyl-2,4-oxazolidinedione IUPAC Name: 5-ethyl-5-methyl-1,3-oxazolidine-2,4-dione
CHEBI:143436 - 5-ethyl-5-methyl-1,3-oxazolidine-2,4-dione (no IUPAC name)
3rd pair:
CHEBI:171837 - xi-Dihydro-5-octyl-2(3H)-furanone IUPAC Name: 5-octyloxolan-2-one
CHEBI:143727 - 5-octyloxolan-2-one (no IUPAC name)
4th pair:
CHEBI:151031 - 1-Piperazinecarboxaldehyde IUPAC Name: piperazine-1-carbaldehyde
CHEBI:46907 - piperazine-1-carbaldehyde (no IUPAC name)
5th pair:
CHEBI:180249 - Hexanethioic acid S-propyl ester IUPAC Name: S-propyl hexanethioate
CHEBI:177491 - S-Propyl hexanethioate IUPAC Name: O-propan-2-yl hexanethioate