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C A E S A

Computer Assisted Estimation of Synthetic Accessibility


Intermediate steps for

Used databases: Aldrich Database, Maybridge Database

full.sd - No. 2

Source file: /var/www/html/caesa_work/preprocess/test2/test2.sd

Score Group Number Database Reference Source Database
32 0 11367 Aldrich Database
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Explanations:
Starting material defined relative
Number of incorrectly mapped olefins : 1
Ease of intercovertibility: Hard (13)
The following synthetic steps were used to generate this starting material
... Oxygen Generalisation (Carboxy)
The following complexity features are fully contained within
this starting materials and are not considered to contribute
to the synthetic complexity of the target structure.
... Formation of an Acylic Carbon-Carbon bond may cause a problem
... 6 Membered ring
... C Substituent on an aromatic ring, carbon on ring
... Olefin
... Olefin with 2 Attachments

Retrosynthetic steps:
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... Organometallic Coupling (Aryl)
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... Carboxy Oxidation
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... Organometallic Coupling (Aryl)
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