CHEBI:16957, the current structure is wrong

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Chemical Entities of Biological Interest (ChEBI) is a freely available dictionary of molecular entities focused on ‘small’ chemical compounds.

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Closed kaxelsen closed 7 years ago

kaxelsen commented 7 years ago

Hi,

The structure of CHEBI:16957, deacetoxyvindolinium has an error in the stereo configuration of C11 (IUPAC numbering according to http://www.chem.qmul.ac.uk/iubmb/enzyme/reaction/alkaloid/alknos/vindol.html).

The bond should go up not down. I have attached the correct structure as mol file. CHEBI_16957.txt

Cheers,

Kristian

G-Owen commented 7 years ago

Hi Kristian,

Now corrected - thanks for letting us know.

Kind regards, Gareth