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· · COA & SDS Disponibile per ogni prodotto · Spedizione lo stesso giorno su articoli in magazzino Isoferulic Acid - analytical standard, Moligand™, ≥98% , Inhibitor of phosphomevalonate kinase, CAS No.537-73-5, Inhibitor of phosphomevalonate kinase
QUALITÀ & PUREZZA Analytical standard ? Analytical standard — certified-purity material for quantitative calibration. Use to prepare calibration standards and validate analytical methods. Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98% Synonyms
Isoferulate|(E)-3-(3-hydroxy-4-methoxyphenyl)acrylicacid|Hesperetic acid|2-Propenoic acid, 3-(3-hydroxy-4-methoxyphenyl)-|3-(3-Hydroxy-4-methoxyphenyl)acrylic acid|trans-Isoferulic acid|ISOFERULIC ACID (CONSTITUENT OF BLACK COHOSH) [DSC]|(E)-3-(3-hydroxy-4-methoxyphenyl)prop-2-enoic acid|3-Hydroxy-4-methoxycinnamic acid (isoferulic acid)|(2E)-3-(3-HYDROXY-4-METHOXYPHENYL)ACRYLIC ACID|Cinnamic acid, 3-hydroxy-4-methoxy-|Isoferulic Acid ,(S)|3-(3-hydroxy-4-methoxyphenyl)prop-2-enoic acid|3-(3-hydroxy-4-methoxyphenyl)-2-Propenoate|3-Hydroxy-4-methoxycinnamic acid, predominantly trans|Hesperetate|3-Hydroxy-4-methoxycinnamic-acid|3-(3-Hydroxy-4-methoxyphenyl)-2-propenoic acid|3-Hydroxy-4-methoxycinnamic acid|3-hydroxy-4-methoxy-cinnamic acid|cis-Isoferulic acid|trans-3-Hydroxy-4-methoxycinnamic acid|(E)-3-(3-hydroxy-4-methoxyphenyl)acrylic acid|(E)-3-(3-hydroxy-4-methoxy-phenyl)-acrylic acid|(2E)-3-(3-Hydroxy-4-methoxyphenyl)-2-propenoic acid #|3-Hydroxy-4-methoxycinnamate|3-hydroxy-4-methoxy-Cinnamate|ISOFERULIC ACID (CONSTITUENT OF BLACK COHOSH)|Isoferulasaure|(E)-3'-Hydroxy-4'-methoxycinnamic acid|3-[3-Hydroxy-4-(methoxy-d3)phenyl]-2-propenoic Acid|4-O-METHYLCAFFEIC ACID|Hesperetinic acid|Isoferulic acid
Specifiche Sinonimi
Isoferulate | (E)-3-(3-hydroxy-4-methoxyphenyl)acrylicacid | Hesperetic acid | 2-Propenoic acid, 3-(3-hydroxy-4-methoxyphenyl)- | 3-(3-Hydroxy-4-methoxyphenyl)acrylic acid | trans-Isoferulic acid | ISOFERULIC ACID (CONSTITUENT OF BLACK COHOSH) [DSC] | (E)-3-(3-hydroxy-4-methoxyphenyl)prop-2-enoic acid | 3-Hydroxy-4-methoxycinnamic acid (i Mostra altro
Specifiche e purezza
analytical standard, Moligand™, ≥98%
Condizioni di conservazione di stoccaggio
Room temperature
Grado
Moligand™, Standard analitico
Meccanismo d'azione
Inhibitor of phosphomevalonate kinase
Nomi e identificatori Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/508813522
Sorrisi canonici
COC1=C(C=C(C=C1)C=CC(=O)O)O
IUPAC Name
(E)-3-(3-hydroxy-4-methoxyphenyl)prop-2-enoic acid
InChIKey
QURCVMIEKCOAJU-HWKANZROSA-N
INCHI
1S/C10H10O4/c1-14-9-4-2-7(6-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)/b5-3+
Isomeri SMILES
COC1=C(C=C(C=C1)/C=C/C(=O)O)O
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2212758&ln=
Dati avanzati Taxonomic Classification Kingdom Organic compounds Superclass Phenylpropanoids and polyketides Classe Cinnamic acids and derivatives Subclass Hydroxycinnamic acids and derivatives Intermediate Tree Nodes Not available Direct Parent Hydroxycinnamic acids Alternative Parents Coumaric acids and derivatives Cinnamic acids Methoxyphenols Styrenes Phenoxy compounds Methoxybenzenes Anisoles Alkyl aryl ethers 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds Molecular Framework Aromatic homomonocyclic compounds Substituents Cinnamic acid - Coumaric acid or derivatives - Hydroxycinnamic acid - Methoxyphenol - Phenoxy compound - Anisole - Methoxybenzene - Styrene - Phenol ether - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Phenol - Monocyclic benzene moiety - Benzenoid - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Ether - Organic oxygen compound - Carbonyl group - Organic oxide - Organooxygen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound Descrizione This compound belongs to the class of organic compounds known as hydroxycinnamic acids. These are compounds containing an cinnamic acid where the benzene ring is hydroxylated. External Descriptors ferulic acids 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.
Struttura 3D Obiettivi associati (umani) Obiettivi associati (non umani) Meccanismi d'azione Certificati (CoA, COO, BSE/TSE e tabella di analisi) Proprietà chimiche e fisiche Punto di fusione (°C) 230°C Peso molecolare 194.180 g/mol XLogP3 1.500 Hydrogen Bond Donor Count 2 Hydrogen Bond Acceptor Count 4 Rotatable Bond Count 3 Exact Mass 194.058 Da Monoisotopic Mass 194.058 Da Topological Polar Surface Area 66.800 Ų Heavy Atom Count 14 Formal Charge 0 Complexity 224.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 0 Undefined Atom Stereocenter Count 0 Defined Bond Stereocenter Count 1 Undefined Bond Stereocenter Count 0 The total count of all stereochemical bonds 1 Covalently-Bonded Unit Count 1
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