Novobiocin sodium - PharmPure™,USP,Moligand™ , DNA gyrase inhibitor, CAS No.1476-53-5, DNA gyrase inhibitor

CAS: 1476-53-5 Cat. No.: N432138 Molecular Weight: 634.61 Beilstein Registry Number: 3892910 EC Number: 216-023-6 PubChem CID: 54730021

COA

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Novobiocin sodium - PharmPure™, USP CAS No(1476-53-5) by Aladdin Scientific

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AVAILABLE TO ORDER

GRADE & PURITY PharmPure™ ? USP ? Moligand™ ?

Synonyms

Storage

Store at 2-8°C

Shipped In

Wet ice

Overview Specifications Names and Identifiers Documentation Advanced Data Taxonomic Classification 3D Structure Associated Targets(Human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Documents & Articles Solution Calculators Reviews

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Why this grade

PharmPure™,USP,Moligand™ Moligand™,PharmPure™,USP for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Store at 2-8°C Ships Wet ice Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

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Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Overview

General Description

Chemical structure: coumarin-glycoside

Application

For the production of positively supercoiled plasmid DNA. Inhibitor of bacterial DNA gyrase and eukaryotic DNA topoisomerase. Inhibitor of retrovirus RNA-dependent DNA-polymerase.

Other Notes

Keep container tightly closed in a dry and well-ventilated place.Keep in a dry place

Specifications

Synonyms

Specifications & Purity

PharmPure™, USP, Moligand™

Biochemical and Physiological Mechanisms

Mode of Action: Inhibits DNA synthesis by inhibiting the enzyme Topoisomerase II. Antimicrobial spectrum: Gram-positive bacterial.

Storage

Store at 2-8°C

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Grade

Moligand™, PharmPure™, USP

Action Type

INHIBITOR

Mechanism of action

DNA gyrase inhibitor

Names and Identifiers

Canonical Smiles	CC1=C(C=CC2=C1OC(=O)C(=C2O)NC(=O)C3=CC(=C(C=C3)[O-])CC=C(C)C)OC4C(C(C(C(O4)(C)C)OC)OC(=O)N)O.[Na+]
IUPAC Name	sodium;4-[[7-(4-carbamoyloxy-3-hydroxy-5-methoxy-6,6-dimethyloxan-2-yl)oxy-4-hydroxy-8-methyl-2-oxochromen-3-yl]carbamoyl]-2-(3-methylbut-2-enyl)phenolate
InChIKey	WWPRGAYLRGSOSU-UHFFFAOYSA-M
INCHI	1S/C31H36N2O11.Na/c1-14(2)7-8-16-13-17(9-11-19(16)34)27(37)33-21-22(35)18-10-12-20(15(3)24(18)42-28(21)38)41-29-23(36)25(43-30(32)39)26(40-6)31(4,5)44-29;/h7,9-13,23,25-26,29,34-36H,8H2,1-6H3,(H2,32,39)(H,33,37);/q;+1/p-1
Isomeric SMILES	CC1=C(C=CC2=C1OC(=O)C(=C2O)NC(=O)C3=CC(=C(C=C3)[O-])CC=C(C)C)OC4C(C(C(C(O4)(C)C)OC)OC(=O)N)O.[Na+]
WGK Germany	2
RTECS	RD5425000
PubChem CID	54730021
Molecular Weight	634.61
Beilstein	3892910

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Phenylpropanoids and polyketides
  - Class Coumarins and derivatives
    - Subclass Coumarin glycosides

Kingdom	Organic compounds
Superclass	Phenylpropanoids and polyketides
Class	Coumarins and derivatives
Subclass	Coumarin glycosides
Intermediate Tree Nodes	Not available
Direct Parent	Coumarin glycosides
Alternative Parents	Phenolic glycosides 4-hydroxycoumarins Hexoses O-glycosyl compounds 1-benzopyrans Benzamides Benzoyl derivatives Pyranones and derivatives Phenoxides Oxanes Heteroaromatic compounds Vinylogous acids Lactones Secondary alcohols Secondary carboxylic acid amides Oxacyclic compounds Dialkyl ethers Carboximidic acids and derivatives Acetals Organic sodium salts Organic oxides Organopnictogen compounds Imines Hydrocarbon derivatives Organic zwitterions
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Coumarin o-glycoside - Coumarin-7-o-glycoside - Phenolic glycoside - 4-hydroxycoumarin - Hydroxycoumarin - Hexose monosaccharide - O-glycosyl compound - Glycosyl compound - 1-benzopyran - Benzopyran - Benzamide - Benzoic acid or derivatives - Benzoyl - Phenoxide - Pyranone - Benzenoid - Monocyclic benzene moiety - Monosaccharide - Oxane - Pyran - Vinylogous acid - Heteroaromatic compound - Lactone - Secondary carboxylic acid amide - Secondary alcohol - Carboxamide group - Acetal - Carboximidic acid derivative - Organoheterocyclic compound - Organic alkali metal salt - Dialkyl ether - Ether - Carboxylic acid derivative - Oxacycle - Organic nitrogen compound - Imine - Organonitrogen compound - Organooxygen compound - Organic zwitterion - Organic salt - Organic sodium salt - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Alcohol - Organic oxygen compound - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as coumarin glycosides. These are aromatic compounds containing a carbohydrate moiety glycosidically bound to a coumarin moiety.
External Descriptors	Not available
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. DOI: 10.1186/s13321-016-0174-y

3D Structure

Associated Targets(Human)

A498 (42825 Activities)

Melt Point(°C)	215°C
Molecular Weight	634.600 g/mol
XLogP3
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	11
Rotatable Bond Count	9
Exact Mass	634.214 Da
Monoisotopic Mass	634.214 Da
Topological Polar Surface Area	199.000 Å²
Heavy Atom Count	45
Formal Charge	0
Complexity	1160.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	4
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	2

Novobiocin sodium - PharmPure™,USP,Moligand™ , DNA gyrase inhibitor, CAS No.1476-53-5, DNA gyrase inhibitor

Why this grade

Storage & shipping

Quality documents

Literature proof

Overview

Specifications

Documentation

📋 Safety Data Sheet (SDS)

✅ Certificate of Analysis (COA)

📊 Datasheet

🔬 Specification Sheet

Advanced Data

Molarity Calculator

Dilution Calculator

Reconstitution Calculator

Customer Reviews

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