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)

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Parameters Provided:

name.synonym = ( )-12(S),13(R)-vernolic acid; ( )-Vernolsaeure; ( )-leukotoxin B; (9Z)-(12S,13R)-12,13-Epoxyoctadecenoic acid; (9Z)-(12S,13R)-12,13-epoxyoctadecenoic acid; 12S,13R-EpOME; Vernolic acid ( )-form; cis-12-Epoxyoctadeca-cis-9-enoic acid; cis-12S,13R,-ep, 9c-
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 '( )-12(S),13(R)-vernolic acid; ( )-Vernolsaeure; ( )-leukotoxin B; (9Z)-(12S,13R)-12,13-Epoxyoctadecenoic acid; (9Z)-(12S,13R)-12,13-epoxyoctadecenoic acid; 12S,13R-EpOME; Vernolic acid ( )-form; cis-12-Epoxyoctadeca-cis-9-enoic acid; cis-12S,13R,-ep, 9c-' 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

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//zinc12.docking.org/results/combination?name.synonym=%28+%29-12%28S%29%2C13%28R%29-vernolic+acid%3B+%28+%29-Vernolsaeure%3B+%28+%29-leukotoxin+B%3B+%289Z%29-%2812S%2C13R%29-12%2C13-Epoxyoctadecenoic+acid%3B+%289Z%29-%2812S%2C13R%29-12%2C13-epoxyoctadecenoic+acid%3B+12S%2C13R-EpOME%3B+Vernolic+acid+%28+%29-form%3B+cis-12-Epoxyoctadeca-cis-9-enoic+acid%3B+cis-12S%2C13R%2C-ep%2C+9c-&filter.purchasability=all

Embed Link to Results

<div id="zinc-link"></div> <script type="text/javascript" src="//zinc12.docking.org/js/embed.js"></script> <script type="text/javascript"> window.zinc.embed('zinc-link', { "name.synonym": "( )-12(S),13(R)-vernolic acid; ( )-Vernolsaeure; ( )-leukotoxin B; (9Z)-(12S,13R)-12,13-Epoxyoctadecenoic acid; (9Z)-(12S,13R)-12,13-epoxyoctadecenoic acid; 12S,13R-EpOME; Vernolic acid ( )-form; cis-12-Epoxyoctadeca-cis-9-enoic acid; cis-12S,13R,-ep, 9c-" }); </script>