Daurisoline - Moligand™, ≥98% , CAS No.70553-76-3

CAS: 70553-76-3 Cat. No.: D418571 Peso molecular: 610.74 Número EC: 683-239-9
Disponible para pedir
GRADE & PURITY 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
CCG-270233 | AC-34009 | D 610 | s9150 | CHEBI:184038 | NCGC00482986-03 | AS-77876 | BDBM50403104 | MFCD00221740 | (1R)-1-[[3-[4-[[(1R)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]phenoxy]-4-hydroxyphenyl]methyl]-6-methoxy-2-methyl-3,4-di
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
Size
Estado
Price
Qty
5mg
D418571-5mg
1
66,90US$
10mg
D418571-10mg
1
116,90US$
25mg
D418571-25mg
1
259,90US$
50mg
D418571-50mg
1
439,90US$
100mg
D418571-100mg
1
659,90US$
Enter a quantity for the sizes you want to add.
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Why this grade

Moligand™, ≥98% Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at -20°C Ships Ice chest + Ice pads 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 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Descripción general

Daurisoline is a kind of alkaloid extracted from the kudzu root of menispermaceae plants.

Specifications

Sinónimos
CCG-270233 | AC-34009 | D 610 | s9150 | CHEBI:184038 | NCGC00482986-03 | AS-77876 | BDBM50403104 | MFCD00221740 | (1R)-1-[[3-[4-[[(1R)-6, 7-dimethoxy-2-methyl-3, 4-dihydro-1H-isoquinolin-1-yl]methyl]phenoxy]-4-hydroxyphenyl]methyl]-6-methoxy-2-methyl-3, 4-di
Especificaciones y pureza
Moligand™, ≥98%
Condiciones de almacenamiento de almacenamiento
Store at -20°C
Enviado en
Ice chest + Ice pads
Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.
Grado
Moligand™
Pureza
≥98%
Propiedades del producto
ALogP7.02
hba_count4
Recuento HBD2
Enlace rotable9
Nombres e identificadores
Pubchem Sid528775622
Sonrisas canónicasCN1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)OC4=C(C=CC(=C4)CC5C6=CC(=C(C=C6CCN5C)OC)O)O)OC)OC
IUPAC Name(1R)-1-[[3-[4-[[(1R)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]phenoxy]-4-hydroxyphenyl]methyl]-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-ol
InChIKeyBURJAQFYNVMZDV-FIRIVFDPSA-N
INCHI1S/C37H42N2O6/c1-38-15-13-26-20-36(43-4)37(44-5)22-29(26)30(38)16-23-6-9-27(10-7-23)45-35-18-24(8-11-32(35)40)17-31-28-21-33(41)34(42-3)19-25(28)12-14-39(31)2/h6-11,18-22,30-31,40-41H,12-17H2,1-5H3/t30-,31-/m1/s1
Isómeros SMILES CN1CCC2=CC(=C(C=C2[C@H]1CC3=CC=C(C=C3)OC4=C(C=CC(=C4)C[C@@H]5C6=CC(=C(C=C6CCN5C)OC)O)O)OC)OC
Peso molecular 610.74
Reaxy-Rn 40179381
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=40179381&ln=

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
SuperclassOrganoheterocyclic compounds
ClaseIsoquinolines and derivatives
SubclassBenzylisoquinolines
Intermediate Tree Nodes Not available
Direct ParentBenzylisoquinolines
Alternative Parents Lignans, neolignans and related compounds  Diphenylethers  Diarylethers  Tetrahydroisoquinolines  Phenoxy compounds  Anisoles  Aralkylamines  Alkyl aryl ethers  1-hydroxy-2-unsubstituted benzenoids  Trialkylamines  Azacyclic compounds  Organopnictogen compounds  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Benzylisoquinoline - Oxyneolignan skeleton - Diphenylether - Diaryl ether - Tetrahydroisoquinoline - Phenoxy compound - Anisole - Phenol ether - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Aralkylamine - Phenol - Monocyclic benzene moiety - Benzenoid - Tertiary aliphatic amine - Tertiary amine - Ether - Azacycle - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Organooxygen compound - Amine - Aromatic heteropolycyclic compound
DescripciónThis compound belongs to the class of organic compounds known as benzylisoquinolines. These are organic compounds containing an isoquinoline to which a benzyl group is attached.
External Descriptors Not available
Estructura 3D
Modelo de Estructura Química Interactiva





Objetivos asociados (humanos)
KCNH2 Tclin Potassium voltage-gated channel subfamily H member 2 (2 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
KCNH2 Tclin HERG (29587 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
A673 (619 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
MDA-MB-453 (1139 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HEK293 (82097 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
MDA-MB-231 (73002 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HCC1806 (544 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HCC1937 (423 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HCC70 (557 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Objetivos asociados (no humanos)
Canis familiaris (36305 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Oryctolagus cuniculus (11301 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
KCNE1 Potassium voltage-gated channel subfamily E member 1 (1 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
KCNH2 Potassium voltage-gated channel subfamily H member 2 (24 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:

Find and download the COA for your product by matching the lot number on the packaging.

14 results found

Lot NumberCertificate TypeFechaArticulo
E2626180Certificate of AnalysisMay 21, 2026 D418571
E2626181Certificate of AnalysisMay 21, 2026 D418571
E2626182Certificate of AnalysisMay 21, 2026 D418571
E2626184Certificate of AnalysisMay 21, 2026 D418571
E2529348Certificate of AnalysisOct 30, 2024 D418571
E2529349Certificate of AnalysisOct 30, 2024 D418571
E2529350Certificate of AnalysisOct 30, 2024 D418571
E2529351Certificate of AnalysisOct 30, 2024 D418571
E2529352Certificate of AnalysisOct 30, 2024 D418571
E2529353Certificate of AnalysisOct 30, 2024 D418571
E2529354Certificate of AnalysisOct 30, 2024 D418571
E2529355Certificate of AnalysisOct 30, 2024 D418571
E2529418Certificate of AnalysisOct 30, 2024 D418571
E2529419Certificate of AnalysisOct 30, 2024 D418571

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Propiedades químicas y físicas
SolubilidadDMSO: 10 mg/mL (16.37 mM)
DMSO (mg/ml) Solubilidad máxima64
DMSO (mM) Solubilidad máxima104.791050084588
Peso molecular610.700 g/mol
XLogP36.400
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count9
Exact Mass610.304 Da
Monoisotopic Mass610.304 Da
Topological Polar Surface Area83.900 Ų
Heavy Atom Count45
Formal Charge0
Complexity917.000
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Citations of This Product
Referencias
1. Junxia Zhang, Changyun Liu, Yupeng Wang, Yusi Chen, Haibao Shang, Wen Zheng, Li Jin, Peng Xie, Yingjia Li, Yahan Liu, Yunxiao Zhang, Yang Wang, Wei Zhao, Han Xiao, Guisong Wang, Xin Zhang, Xiaolei Yang, Erdan Dong, Yan Zhang.  (2026)  Bacteroides acidifaciens exacerbates cardiac ischemia/reperfusion injury via the microbial-host isozyme DPP4.  Cell Host & Microbe,      [PMID:41923637] [10.1016/j.chom.2026.03.012]
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📚 Citations by Application

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