C A E S A

Computer Assisted Estimation of Synthetic Accessibility

Intermediate steps for	Used databases:	Aldrich Database, Maybridge Database
vasotec.mol	Source file:	/var/www/html/caesa_work/preprocess/top_drugs/top_drugs.sd

Score	Group Number	Database Reference	Source Database
35	0	55017	Maybridge Database

Explanations:

Starting material defined relative
STEREO: Mapped 1 Inverted 0 Undefined 0
Ease of intercovertibility: Reasonable (6)
The following synthetic steps were used to generate this starting material
... Acetoacetic Ester Synthesis 2
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.
... 5 Membered ring
... Cyclic appendage with heteroatom alpha
... Secondary Stereocentre
... Cyclic Stereocentre
... Isolated Stereocentre

Retrosynthetic steps:

... Grignard

... Carboxy Oxidation

C A E S A

Intermediate steps for

vasotec.mol