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#311 Formula calculation / structure unicity

v1.0 (example)
closed-fixed
5
2015-11-17
2010-07-20
Anne Morgat
No

Hi,

Warning, it seems that the R-groups are not taken into account in the formula calculation.
See the CHEBI:59796 compounds (No R in the formula).

Certainly related (presence of R-groups) I have been allowed to create this structure whereas it already exists in ChEBI
CHEBI:57643 - 1,2-diacyl-sn-glycero-3-phosphocholine (-1)

Eventually, how can I delete CHEBI:59796 ??

Cheers, Anne

Discussion

  • Adriano Dekker

    Adriano Dekker - 2010-10-19
    • assigned_to: nobody --> adekker2
     
  • Adriano Dekker

    Adriano Dekker - 2010-10-19

    Not sure if formula generation library marvin-beans supports including R groups in formulae but we'll investigate.

     
  • Venkatesh Muthukrishnan

    • status: open --> closed-fixed
    • Group: --> v1.0 (example)
     
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