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

CAS: 70553-76-3 Cat. No.: D418571 분자식: C37H42N2O6 분자량: 610.74 EC 번호: 683-239-9
주문 가능
등급 & 순도 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
★
크기
USA
독일 (EU)*
가격
수량
5mg
D418571-5mg
1 재고 있음
—
US$66.90
10mg
D418571-10mg
1 재고 있음
—
US$116.90
25mg
D418571-25mg
1 재고 있음
—
US$259.90
50mg
D418571-50mg
1 재고 있음
—
US$439.90
100mg
D418571-100mg
1 재고 있음
—
US$659.90
Enter a quantity for the sizes you want to add.
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이 등급을 선택하는 이유

Moligand™, ≥98% Moligand™ 최소한의 기준선 간섭이 필요한 민감한 크로마토그래피 및 분석 워크플로우용.

🌡

보관 및 배송

Store at -20°C Ice chest + Ice pads 출고. 정확한 사양은 로트별 COA를 확인하세요.

📋

품질 문서

SDS, COA, 데이터시트, 사양서를 다운로드할 수 있습니다. 로트별 COA는 로트 번호 조회를 통해 확인할 수 있습니다.

📚

문헌적 근거

크로마토그래피, 유기 합성 및 교차 커플링 반응 분야의 동료 심사 논문 1편에서 인용되었습니다.

개요

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

사양

동의어
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
사양 및 순도
Moligand™, ≥98%
보관 조건
Store at -20°C
배송
Ice chest + Ice pads
이 제품은 콜드 체인 배송이 필요합니다.지상 및 기타 경제 서비스는 사용할 수 없습니다.
등급
Moligand™
순수함
≥98%
제품 특성
ALogP
7.02
hba_count
4
HBD 수
2
회전 가능한 결합
9
이름과 식별자
Pubchem Sid
정식 스마일
CN1CCC2=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
InChIKey
BURJAQFYNVMZDV-FIRIVFDPSA-N
INCHI
1S/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
이성체 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
분자량
610.74
Reaxy-Rn
40179381
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=40179381&ln=

문서

📋 안전 데이터 시트(SDS)

위험성, 취급, 보관 및 규제 준수를 포괄하는 종합 문서.

<<<<<<< HEAD SDS 다운로드 → ======= SDS 다운로드 → >>>>>>> release248-p3

✅ 분석 성적서(COA)

로트별 품질 데이터. 로트 번호를 입력하여 정확한 COA를 확인하세요.

COA 조회 →

📊 데이터시트

제품 사양 및 응용 분야에 대한 빠른 참조 요약.

데이터시트 보기 →

🔬 사양서

이 등급의 전체 품질 특성 및 합격 기준.

사양서 보기 →

고급 데이터

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
분류Isoquinolines 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
설명This 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
3D 구조
상호 작용 화학 구조 모델





관련 대상(인간)
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
관련 대상(비인간)
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
작용 메커니즘
인증서(CoA, COO, BSE/TSE 및 분석 차트)
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 Type날짜항목
E2626180E2626180Certificate of AnalysisMay 21, 2026 D418571
E2626181E2626181Certificate of AnalysisMay 21, 2026 D418571
E2626182E2626182Certificate of AnalysisMay 21, 2026 D418571
E2626184E2626184Certificate of AnalysisMay 21, 2026 D418571
E2529348E2529348Certificate of AnalysisOct 30, 2024 D418571
E2529349E2529349Certificate of AnalysisOct 30, 2024 D418571
E2529350E2529350Certificate of AnalysisOct 30, 2024 D418571
E2529351E2529351Certificate of AnalysisOct 30, 2024 D418571
E2529352E2529352Certificate of AnalysisOct 30, 2024 D418571
E2529353E2529353Certificate of AnalysisOct 30, 2024 D418571
E2529354E2529354Certificate of AnalysisOct 30, 2024 D418571
E2529355E2529355Certificate of AnalysisOct 30, 2024 D418571
E2529418E2529418Certificate of AnalysisOct 30, 2024 D418571
E2529419E2529419Certificate of AnalysisOct 30, 2024 D418571
화학 및 물리적 특성
용해성DMSO: 10 mg/mL (16.37 mM)
DMSO(mg/mL) 최대 용해도64
DMSO(mM) 최대 용해도104.791050084588
분자량610.700 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
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