Functional Group

acetal/ketal acetal_or_ketal parent group

A compound has acetal/ketal when it has any of the groups below. A parent group is never matched itself, and its count of a compound is the number of occurrences of all of them together.

Groups directly under it

acetal acetal
Query graph of acetal
within: acetal/ketal
ketal ketal
Query graph of ketal
within: acetal/ketal

In the ATB

  • 3,414 annotated compounds have it;
  • 34 of them have experimental reference data;
  • 255 are monofunctional: this is their only group, once (rings count as groups, so a phenol is not).

The annotated compounds are those with experimental reference data plus small, neutral organic compounds (up to 12 heavy atoms), not every ATB molecule. Through the API: GET /api/v1/molecules?functional_group=acetal_or_ketal.

Annotation scheme 2.