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Hello,
The submission tool isn't loading for me, so I'm creating a SF ticket instead. Please could I have a new ChEBI entry:
name: (5Z,8S,9E,11Z,14Z)-8-hydroperoxyicosa-5,9,11,14-tetraenoate
synony…
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Hi,
I need this compound for Rhea:10936, EC 1.8.5.2.
KEGG: C15494
Output from ChEBI submission tool beta:
<?xml version="1.0" encoding="UTF-8"?>
<cml dictRef="ebiMolecule:ebiMoleculeDict.…
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Dear ChEBI curators;
I'd like to request to correct the names I submitted for CHEBI:87843, I completely forgot to add the 3-oxo (or 3-keto) infront of the icosanoyl. Can you please add it to each of t…
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Hi, to help the adoption of the SPLASH,
so we can either 1) use the R package splashR
from https://github.com/berlinguyinca/spectra-hash/tree/master/splashR
or 2) do the dirty way and copy https://gi…
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There are differences for the calculated properties available for compounds only now in ChEMBL 20.
Two examples:
OPS2824291 only has MW
OPS2778764 has SMILES, inchi as well
Why are these differences…
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For ursodeoxycholic acid, CHEBI:9907, the 'opening paragraph' of Wikipedia information is dragging back the ChemBox identifiers as well:
Wikipedia
License
Ursodiol, also known as ursodeoxycholic aci…
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The latest chebi_complete.sdf has two newlines after the SMILES property on molecule 3309
Since SDF is a legacy format where newline actually means something, we suggest to implement a quality control…
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We need to complete the dataset in the Master Sheet for OSM Series 1 compounds before we submit the relevant paper in the near future. The dataset will allow readers of the paper to browse the series …