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· · COA & SDS すべての製品に適用 · 在庫品は当日出荷 C75 - Moligand™,≥99% , CAS No.218137-86-1
グレード＆純度 Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥99% Synonyms
4-methylidene-2-octyl-5-oxotetrahydrofuran-3-carboxylic acid|4-methylidene-2-octyl-5-oxooxolane-3-carboxylic acid|FAS inhibitor C75|C-75|4-Methylene-2-octyl-5-oxo-tetrahydro-furan-3-carboxylic acid|4-Methylene-2-octyl-5-oxotetrahydrofuran-3-carboxylic acid|C75;C 75;FAS inhibitor C75|tetrahydro-4-methylene-2-octyl-5-oxo-3-furancarboxylic acid|3-Furancarboxylic acid, tetrahydro-4-methylene-2-octyl-5-oxo-
Shipped In
Ice chest + Ice pads
概要 C75 is a synthetic fatty-acid synthase (FASN) inhibitor; inhibits prostate cancer cells PC3 with an IC50 of 35 μM[1][2][3]. C75 is a potent CPT1A activator.
仕様 同義語
4-methylidene-2-octyl-5-oxotetrahydrofuran-3-carboxylic acid | 4-methylidene-2-octyl-5-oxooxolane-3-carboxylic acid | FAS inhibitor C75 | C-75 | 4-Methylene-2-octyl-5-oxo-tetrahydro-furan-3-carboxylic acid | 4-Methylene-2-octyl-5-oxotetrahydrofuran-3-carboxylic acid | C75;C 75;FAS inhibitor C75 | tetrahydro-4-methylene-2-octyl-5-oxo-3-fur もっと見る
入荷
Ice chest + Ice pads
この製品は冷冷この冷このこの製品の運送が必要です。地上およびその他の経済サービスは利用できません。
名前と識別子 カノニカル・スマイル
CCCCCCCCC1C(C(=C)C(=O)O1)C(=O)O
IUPAC Name
4-methylidene-2-octyl-5-oxooxolane-3-carboxylic acid
InChIKey
VCWLZDVWHQVAJU-UHFFFAOYSA-N
INCHI
1S/C14H22O4/c1-3-4-5-6-7-8-9-11-12(13(15)16)10(2)14(17)18-11/h11-12H,2-9H2,1H3,(H,15,16)
異性体SMILES
CCCCCCCCC1C(C(=C)C(=O)O1)C(=O)O
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=9925444&ln=
詳細データ Taxonomic Classification Kingdom Organic compounds Superclass Organoheterocyclic compounds 分類 Lactones Subclass Gamma butyrolactones Intermediate Tree Nodes Not available Direct Parent Gamma butyrolactones Alternative Parents Dicarboxylic acids and derivatives Tetrahydrofurans Enoate esters Oxacyclic compounds Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds Molecular Framework Aliphatic heteromonocyclic compounds Substituents Gamma butyrolactone - Dicarboxylic acid or derivatives - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Tetrahydrofuran - Carboxylic acid ester - Oxacycle - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic heteromonocyclic compound 説明 This compound belongs to the class of organic compounds known as gamma butyrolactones. These are compounds containing a gamma butyrolactone moiety, which consists of an aliphatic five-member ring with four carbon atoms, one oxygen atom, and bears a ketone group on the carbon adjacent to the oxygen atom. External Descriptors Not available Data sources 1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
3 D構造 関連ターゲット（人間） 関連ターゲット（非人間） 作用メカニズム 証明書（CoA、COO、BSE/TSEと分析図） 化学的性質と物理的性質 溶解度 DMSO : ≥ 83.3 mg/mL (327.54 mM) H2O : <0.1 mg/mL (ultrasonic) (insoluble) 分子量 254.320 g/mol XLogP3 4.000 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 4 Rotatable Bond Count 8 Exact Mass 254.152 Da Monoisotopic Mass 254.152 Da Topological Polar Surface Area 63.600 Ų Heavy Atom Count 18 Formal Charge 0 Complexity 322.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 0 Undefined Atom Stereocenter Count 2 Defined Bond Stereocenter Count 0 Undefined Bond Stereocenter Count 0 The total count of all stereochemical bonds 0 Covalently-Bonded Unit Count 1
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