Carbohydrate structures in entries from ChEMBL

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#224 Carbohydrate structures in entries from ChEMBL

Milestone: v1.0 (example)

Status: closed

Owner: Janna Hastings

Labels: ChEBI Loader (19)

Priority: 5

Updated: 2015-11-17

Created: 2009-09-10

Creator: Marcus Ennis

Private: No

The display of pyranose rings as chair conformations, although interpretable by the human brain, canot be handled by computers, with the result that the InChI generated will include no stereochemical information. An example is CHEBI:283904: mankind recognises this as a D-glucopyranose derivative, but the software does not reason similarly and so assumes that it is merely a pyran derivative with no stereochem specified. We will need in future all such structures shown as stereo projections (cf. CHEBI:37657).

Marcus

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Venkatesh Muthukrishnan - 2015-11-17

status: open --> closed

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#224 Carbohydrate structures in entries from ChEMBL

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