10 Citations
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Basic Description
| Synonyms | Pyrvinium pamoate | 3546-41-6 | Pyrvinium embonate | DTXSID4023545 | Pyrvinium (as embonate) | DTXCID503545 | Pyrviniumpamoate | 2-(2-(2,5-Dimethyl-1-phenyl-1H-pyrrol-3-yl)vinyl)-6-(dimethylamino)-1-methylquinolin-1-ium bis-4,4'-methylenebis(3-hydroxy-2-naphthoate) | Van |
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| Specifications & Purity | 10mM in DMSO |
| Biochemical and Physiological Mechanisms | Enpovidam is an effective androgen receptor inhibitor. Androgen receptor (AR) is a nuclear hormone receptor / transcription factor, which exists in the cytoplasm and can be activated by testosterone and dihydrotestosterone. AR inhibitors have potential th |
| Storage Temp | Store at -80°C |
| Shipped In |
Ice chest + Ice pads This product requires cold chain shipping. Ground and other economy services are not available. |
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Benzenoids
- Class Naphthalenes
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Superclass
Benzenoids
| Kingdom | Organic compounds |
|---|---|
| Superclass | Benzenoids |
| Class | Naphthalenes |
| Subclass | Naphthalenecarboxylic acids and derivatives |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Naphthalenecarboxylic acids |
| Alternative Parents | Phenylpyrroles Aminoquinolines and derivatives Dialkylarylamines Phenoxides Pyridinium derivatives Dicarboxylic acids and derivatives Vinylogous acids Heteroaromatic compounds Carboxylic acids Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organic salts Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Not available |
| Substituents | 2-naphthalenecarboxylic acid - Aminoquinoline - 1-phenylpyrrole - Quinoline - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Phenoxide - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Pyridine - Pyridinium - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Vinylogous acid - Tertiary amine - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Carboxylic acid - Amine - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Organic salt - Organic oxide - Aromatic heteropolycyclic compound |
| Description | This compound belongs to the class of organic compounds known as naphthalenecarboxylic acids. These are compounds containing a naphthalene moiety, which bears a carboxylic acid group one or more positions. Naphthalene is a bicyclic compound that is made up of two fused benzene ring. |
| External Descriptors | Not available |
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Associated Targets(Human)
APEX1
Tchem
DNA-(apurinic or apyrimidinic site) lyase (38016 Activities)
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TDP1
Tchem
Tyrosyl-DNA phosphodiesterase 1 (345557 Activities)
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SLCO1B1
Tchem
Solute carrier organic anion transporter family member 1B1 (2672 Activities)
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SLCO1B3
Tchem
Solute carrier organic anion transporter family member 1B3 (2517 Activities)
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Associated Targets(non-human)
Candida albicans (78123 Activities)
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BHK-21 (725 Activities)
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LLC-MK2 (227 Activities)
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Fumarate reductase (7 Activities)
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SARS-CoV-2 (38078 Activities)
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Mechanisms of Action
| Mechanism of Action | Action Type | target ID | Target Name | Target Type | Target Organism | Binding Site Name | References |
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Names and Identifiers
| IUPAC Name | 3-carboxy-1-[(3-carboxy-2-oxidonaphthalen-1-yl)methyl]naphthalen-2-olate;2-[(E)-2-(2,5-dimethyl-1-phenylpyrrol-3-yl)ethenyl]-N,N,1-trimethylquinolin-1-ium-6-amine |
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| INCHI | InChI=1S/2C26H28N3.C23H16O6/c2*1-19-17-21(20(2)29(19)24-9-7-6-8-10-24)11-13-23-14-12-22-18-25(27(3)4)15-16-26(22)28(23)5;24-20-16(14-7-3-1-5-12(14)9-18(20)22(26)27)11-17-15-8-4-2-6-13(15)10-19(21(17)25)23(28)29/h2*6-18H,1-5H3;1-10,24-25H,11H2,(H,26,27)(H,28,29)/q2*+1;/p-2 |
| InChIKey | OOPDAHSJBRZRPH-UHFFFAOYSA-L |
| Smiles | CC1=CC(=C(N1C2=CC=CC=C2)C)C=CC3=[N+](C4=C(C=C3)C=C(C=C4)N(C)C)C.CC1=CC(=C(N1C2=CC=CC=C2)C)C=CC3=[N+](C4=C(C=C3)C=C(C=C4)N(C)C)C.C1=CC=C2C(=C1)C=C(C(=C2CC3=C(C(=CC4=CC=CC=C43)C(=O)O)[O-])[O-])C(=O)O |
| Isomeric SMILES | CC1=CC(=C(N1C2=CC=CC=C2)C)/C=C/C3=[N+](C4=C(C=C(C=C4)N(C)C)C=C3)C.CC1=CC(=C(N1C2=CC=CC=C2)C)/C=C/C3=[N+](C4=C(C=C(C=C4)N(C)C)C=C3)C.C1=CC=C2C(=C(C(=CC2=C1)C(=O)O)[O-])CC3=C(C(=CC4=CC=CC=C34)C(=O)O)[O-] |
| PubChem CID | 54680693 |
| Molecular Weight | 1151.39 |
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Chemical and Physical Properties
| Melt Point(°C) | 215-223° C |
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| Molecular Weight | 1151.400 g/mol |
| XLogP3 | |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 12 |
| Exact Mass | 1150.54 Da |
| Monoisotopic Mass | 1150.54 Da |
| Topological Polar Surface Area | 145.000 Ų |
| Heavy Atom Count | 87 |
| Formal Charge | 0 |
| Complexity | 1120.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 2 |
| Covalently-Bonded Unit Count | 3 |
Citations of This Product
Solution Calculators
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