Asimilobine , CAS No.6871-21-2

CAS: 6871-21-2 Cat. No.: A647685 분자식: C17H17NO2 분자량: 267.32 EC 번호: 881-576-8 PubChem CID: 160875
주문 가능
Synonyms
CHEBI:70637 | 6abeta-Noraporphin-2-ol, 1-methoxy- | DTXSID00988410 | Q4H26TGS8S | R-(-)-asimilobine | FS-8822 | UNII-Q4H26TGS8S | (6AR)-5,6,6A,7-TETRAHYDRO-1-METHOXY-4H-DIBENZO(DE,G)QUINOLIN-2-OL | 4H-Dibenzo(de,g)quinolin-2-ol, 5,6,6a,7-tetrahydro-1-meth
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
★
Size
USA
독일 (EU)*
Price
Qty
1mg
A647685-1mg
주문제작 · 8~12주
US$196.90
5mg
A647685-5mg
주문제작 · 8~12주
US$480.90
Enter a quantity for the sizes you want to add.
🧪

Why this grade

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

개요

Asimilobine is an aporphine isoquinoline alkaloid isolated from plant species of Magnolia obobata Thun. Asimilobine is a dopamine biosynthesis inhibitor and a serotonergic receptor antagonist. Asimilobine shows an antimalarial and anti-cancer activity

In Vitro

Asimilobine (0.05-0.2 μM; for 24 h) shows a significant inhibition of intracellular dopamine levels in a concentration-dependent manner with an IC 50 value of 0.13 μM. Asimilobine (0.15 μM) inhibits tyrosine hydroxylase (TH) and aromatic L-amino acid decarboxylase (AADC) activities at 24 h. Asimilobine also decreases TH mRNA levels and intracellular cyclic AMP levels. MCE has not independently confirmed the accuracy of these methods. They are for reference only.

IC50& Target:Plasmodium|Dopamine Receptor|serotonergic receptor

Specifications

동의어
CHEBI:70637 | 6abeta-Noraporphin-2-ol, 1-methoxy- | DTXSID00988410 | Q4H26TGS8S | R-(-)-asimilobine | FS-8822 | UNII-Q4H26TGS8S | (6AR)-5,6,6A,7-TETRAHYDRO-1-METHOXY-4H-DIBENZO(DE,G)QUINOLIN-2-OL | 4H-Dibenzo(de,g)quinolin-2-ol, 5,6,6a,7-tetrahydro-1-meth
생화학 및 생리적 메커니즘
Asimilobine is an aporphine isoquinoline alkaloid isolated from plant species of Magnolia obobata Thun. Asimilobine is a dopamine biosynthesis inhibitor and a serotonergic receptor antagonist. Asimilobine shows an antimalarial and anti-cancer activity
보관 조건
Store at -20°C
배송
Ice chest + Ice pads
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작업 유형
INHIBITOR
이름과 식별자
정식 스마일COC1=C(C=C2CCNC3C2=C1C4=CC=CC=C4C3)O
IUPAC Name(6aR)-1-methoxy-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-2-ol
InChIKeyNBDNEUOVIJYCGZ-CYBMUJFWSA-N
INCHI1S/C17H17NO2/c1-20-17-14(19)9-11-6-7-18-13-8-10-4-2-3-5-12(10)16(17)15(11)13/h2-5,9,13,18-19H,6-8H2,1H3/t13-/m1/s1
이성체 SMILES COC1=C(C=C2CCN[C@H]3C2=C1C4=CC=CC=C4C3)O
PubChem CID 160875
분자량 267.32

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
SuperclassAlkaloids and derivatives
분류Aporphines
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentAporphines
Alternative Parents Phenanthrenes and derivatives  Benzoquinolines  Naphthols and derivatives  Tetrahydroisoquinolines  Anisoles  Aralkylamines  Alkyl aryl ethers  1-hydroxy-2-unsubstituted benzenoids  Dialkylamines  Azacyclic compounds  Organopnictogen compounds  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Aporphine - Benzoquinoline - Phenanthrene - 2-naphthol - Naphthalene - Quinoline - Tetrahydroisoquinoline - Anisole - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Aralkylamine - Benzenoid - Azacycle - Ether - Secondary aliphatic amine - Secondary amine - Organoheterocyclic compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Amine - Aromatic heteropolycyclic compound
설명This compound belongs to the class of organic compounds known as aporphines. These are quinoline alkaloids containing the dibenzo[de,g]quinoline ring system or a dehydrogenated derivative thereof.
External Descriptors isoquinoline alkaloid
3D 구조
상호 작용 화학 구조 모델





관련 대상(인간)
ACHE Tclin Acetylcholinesterase (18204 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HT-1080 (3966 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
SK-MEL-2 (46422 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
ZR-75-1 (953 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
A-431 (6446 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
KB (17409 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
LNCaP (8286 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
관련 대상(비인간)
Plasmodium falciparum (966862 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
P388 (20296 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
작용 메커니즘
인증서(CoA, COO, BSE/TSE 및 분석 차트)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
화학 및 물리적 특성
분자량267.320 g/mol
XLogP32.600
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass267.126 Da
Monoisotopic Mass267.126 Da
Topological Polar Surface Area41.500 Ų
Heavy Atom Count20
Formal Charge0
Complexity361.000
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
솔루션 계산기
리뷰

고객 리뷰

자주 묻는 질문

How should this product be stored?
Store at ?20 °C. Freezer storage is required to maintain the specified shelf life.
How is this product shipped?
This product ships in an insulated container with ice pads. Unpack on arrival and transfer it to the storage condition stated above.
What are the CAS number, molecular formula and molecular weight?
The CAS Number is 6871-21-2, the molecular formula is C17H17NO2, and the molecular weight is 267.32 g/mol. InChIKey NBDNEUOVIJYCGZ-CYBMUJFWSA-N.
What documentation is provided?
Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.

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