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The chebi.owl available here ftp://ftp.ebi.ac.uk/pub/databases/chebi/ontology/
is potentially confusing to users. It uses an annotation vocabulary that is non-standard and unique to CHEBI.
I recomme…
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Name: bicyclic nitroimidazole
CHEMBASE:474514 - http://www.chembase.com/cbid\_474514.htm
PubChem:474514 - http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=00474514
no CAS number given
Formula:…
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1)
name: 2-bromo-2-(((4-methylphenyl)sulfonyl)methyl)-1-indanone
NSC 280891
CAS Registry Number: 72848-61-4
InChIKey: XPXBWHGWVJYCKM-UHFFFAOYSA-N
SMILES: CC1=CC=C(C=C1)S(=O)C[C]2(Br)CC3=CC=CC=C3C2=O
h…
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poly(propylene glycol) CHEBI:53262
pluronic P-123 CHEBI:53515
Many thanks,
Colin.
Reported by: batchelorc
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For example in the case of S-Metolachlor
http://www.alanwood.net/pesticides/s-metolachlor.html
the HTML snippet for the InChiKey is
``` html
InChIKey:
major component (S)-isomer:WVQBLGZPHOPPFO-LBP…
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Hello,
For macromolecules, those with []ht/n bracketses, for example CHEBI:53424, the submission tool should ensure that no InChI is deposited.
Will be along shortly with a list of entries that need…
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Priority: Low (1)
See:
http://en.wikipedia.org/wiki/Cortistatins
isa: steroid alkaloid (CHEBI:26767)
IUPACName = (1''R'',2''R'',3''S'',5''R'',8β,17β)-3-(Dimethylamino)-17-(isoquinolin-7-yl)-5,8-epo…
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We would like this new term for PomBase's phenotype ontology:
Details from PubChem Compound CID 54598570 record ...
CAS registry: 7044-24-8
IUPAC Name: 2-[(E)-[4-[(Z)-(diaminomethylidenehydrazinyli…
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http://en.wikipedia.org/wiki/Phosphatidylserine
based on PMID:10770950 I think it should be
is_a: CHEBI:60971 ! aminophospholipid
Additional info from wikipedia:
ChemSpiderID = 13628254
| InChI =…
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Summary and proposed model:
http://wiki.wormbase.org/index.php/Molecule#Changes_for_WS251
As proposed following discussion and edits (Sept 4th)
```
?Molecule Name ?Text //WBMoleculeID
Publ…