ZINC 12

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Format: Overview Compact Basic Summary Targets List Properties Purchasing Info Catalog Info SDF CAS SMILES MOL2 Flexibase ZINC Names Names+Smiles 800lb Gorilla MOL2 (e.g. PyMol) SDF (e.g. Chimera) SMILES (e.g. Marvin) Gorilla (e.g. Instant JChem) Representations: Default All Single Usual Metals Reference Mid High Low Purchasability: Purchasable In Stock or On Demand In Stock Only Make On Demand Boutique Not For Sale Annotated Model Systems Collabocules Everything Boutique (at any price)

• 1577197

Parameters Provided:

name.synonym = 1-Heptaldehyde; 1-Heptanal; Enanthal; Enanthaldehyde; Enanthic aldehyde; Enanthole; Heptaldehyde; heptan-1-al; Heptanaldehyde; Heptyl aldehyde; Kohlenstoff; n-Heptaldehyde; n-Heptanal; n-Heptylaldehyde; Oenanthal; Oenanthaldehyde; Oenanthic aldehyde; Oena
filter.purchasability = all
page.num = 1

Structural Results Found: (before additional filtering)

SQL Query Was

SELECT DISTINCT(ci.sub_id_fk) AS sub_id FROM catalog_item AS ci INNER JOIN catalog AS c ON ci.cat_id_fk=c.cat_id INNER JOIN synonym AS syn ON (ci.cat_id_fk=syn.cat_fk AND ci.supplier_code=syn.supplier_code) INNER JOIN field AS f ON syn.field_fk=f.field_id  WHERE c.free = 1 AND syn.synonym IS NOT NULL AND syn.synonym LIKE '1-Heptaldehyde; 1-Heptanal; Enanthal; Enanthaldehyde; Enanthic aldehyde; Enanthole; Heptaldehyde; heptan-1-al; Heptanaldehyde; Heptyl aldehyde; Kohlenstoff; n-Heptaldehyde; n-Heptanal; n-Heptylaldehyde; Oenanthal; Oenanthaldehyde; Oenanthic aldehyde; Oena' AND f.ftype IN (3,7,11,12,14) AND ci.sub_id_fk IN (SELECT ci.sub_id_fk AS sub_id FROM catalog_item AS ci INNER JOIN catalog AS c ON ci.cat_id_fk=c.cat_id  WHERE c.free = 1   )    LIMIT 50

Permalink

//zinc12.docking.org/results/combination?name.synonym=1-Heptaldehyde%3B+1-Heptanal%3B+Enanthal%3B+Enanthaldehyde%3B+Enanthic+aldehyde%3B+Enanthole%3B+Heptaldehyde%3B+heptan-1-al%3B+Heptanaldehyde%3B+Heptyl+aldehyde%3B+Kohlenstoff%3B+n-Heptaldehyde%3B+n-Heptanal%3B+n-Heptylaldehyde%3B+Oenanthal%3B+Oenanthaldehyde%3B+Oenanthic+aldehyde%3B+Oena&filter.purchasability=all

Embed Link to Results

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