Canagliflozin hemihydrate - 10mM in DMSO , CAS No.928672-86-0

CAS: 928672-86-0 Cat. No.: C426963 Peso molecular: 907.05 Número EC: 620-201-2 PubChem CID: 24997615
Disponible para pedir
GRADE & PURITY 10mM in DMSO
Synonyms
canagliflozin hemihydrate|928672-86-0|Invokana|Canagliflozin hydrate|Cagliflozin hemihydrate|CHEBI:73272|0SAC974Z85|JNJ-24831754-ZAE|JNJ-28431754-AAA|(1S)-1,5-Anhydro-1-(3-((5-(4-fluorophenyl)-2-thienyl)methyl)-4-methylphenyl)-D-glucitol hemihydrate|Canag
Storage
Store at -80°C
Shipped In
Dry ice packs + Cold packs
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
1ml
C426963-1ml
2

179,90US$

262,90US$
Guardar 83,00 US$ (31.57%)
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Why this grade

10mM in DMSO for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at -80°C Ships Dry ice packs + Cold packs Check lot-specific COA for exact specifications.

📋

Quality documents

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

📚

Literature proof

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

Specifications

Sinónimos
canagliflozin hemihydrate | 928672-86-0 | Invokana | Canagliflozin hydrate | Cagliflozin hemihydrate | CHEBI:73272 | 0SAC974Z85 | JNJ-24831754-ZAE | JNJ-28431754-AAA | (1S)-1, 5-Anhydro-1-(3-((5-(4-fluorophenyl)-2-thienyl)methyl)-4-methylphenyl)-D-glucitol hemihydrate | Canag
Especificaciones y pureza
10mM in DMSO
Condiciones de almacenamiento de almacenamiento
Store at -80°C
Enviado en
Dry ice packs + Cold packs
Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.
Nombres e identificadores
Sonrisas canónicasCC1=C(C=C(C=C1)C2C(C(C(C(O2)CO)O)O)O)CC3=CC=C(S3)C4=CC=C(C=C4)F.CC1=C(C=C(C=C1)C2C(C(C(C(O2)CO)O)O)O)CC3=CC=C(S3)C4=CC=C(C=C4)F.O
IUPAC Name(2S,3R,4R,5S,6R)-2-[3-[[5-(4-fluorophenyl)thiophen-2-yl]methyl]-4-methylphenyl]-6-(hydroxymethyl)oxane-3,4,5-triol;hydrate
InChIKeyVHOFTEAWFCUTOS-TUGBYPPCSA-N
INCHI1S/2C24H25FO5S.H2O/c2*1-13-2-3-15(24-23(29)22(28)21(27)19(12-26)30-24)10-16(13)11-18-8-9-20(31-18)14-4-6-17(25)7-5-14;/h2*2-10,19,21-24,26-29H,11-12H2,1H3;1H2/t2*19-,21-,22+,23-,24+;/m11./s1
Isómeros SMILES CC1=C(C=C(C=C1)[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)CC3=CC=C(S3)C4=CC=C(C=C4)F.CC1=C(C=C(C=C1)[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)CC3=CC=C(S3)C4=CC=C(C=C4)F.O
PubChem CID 24997615
Peso molecular 907.05

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

KingdomOrganic compounds
SuperclassOrganic oxygen compounds
ClaseOrganooxygen compounds
SubclassCarbohydrates and carbohydrate conjugates
Intermediate Tree Nodes Glycosyl compounds
Direct ParentPhenolic glycosides
Alternative Parents Hexoses  C-glycosyl compounds  Toluenes  2,5-disubstituted thiophenes  Fluorobenzenes  Aryl fluorides  Oxanes  Heteroaromatic compounds  Secondary alcohols  Polyols  Oxacyclic compounds  Dialkyl ethers  Primary alcohols  Organofluorides  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkNot available
Substituents Phenolic glycoside - Hexose monosaccharide - C-glycosyl compound - Fluorobenzene - Halobenzene - Toluene - 2,5-disubstituted thiophene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Monosaccharide - Oxane - Benzenoid - Heteroaromatic compound - Thiophene - Secondary alcohol - Oxacycle - Ether - Dialkyl ether - Polyol - Organoheterocyclic compound - Alcohol - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Primary alcohol - Organic oxide - Aromatic heteromonocyclic compound
DescripciónThis compound belongs to the class of organic compounds known as phenolic glycosides. These are organic compounds containing a phenolic structure attached to a glycosyl moiety. Some examples of phenolic structures include lignans, and flavonoids. Among the sugar units found in natural glycosides are D-glucose, L-Fructose, and L rhamnose.
External Descriptors hydrate
Estructura 3D
Modelo de Estructura Química Interactiva





Objetivos asociados (humanos)
SLC5A2 Tclin Sodium/glucose cotransporter 2 (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
Objetivos asociados (no humanos)
Slc5a2 Sodium/glucose cotransporter 2 (17 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Rattus norvegicus (775804 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mecanismos de acción
Certificados (CoA, COO, BSE/TSE y tabla de análisis)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Propiedades químicas y físicas
Peso molecular907.000 g/mol
XLogP3
Hydrogen Bond Donor Count9
Hydrogen Bond Acceptor Count15
Rotatable Bond Count10
Exact Mass906.292 Da
Monoisotopic Mass906.292 Da
Topological Polar Surface Area238.000 Ų
Heavy Atom Count63
Formal Charge0
Complexity574.000
Isotope Atom Count0
Defined Atom Stereocenter Count10
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count3
Calculadoras de soluciones
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