Anabasine - ≥90% , CAS No.13078-04-1

CAS: 13078-04-1 Cat. No.: A493484 분자식: C10H14N2 분자량: 162.23 Beilstein Registry Number: 82639 EC 번호: 621-972-8
주문 가능
GRADE & PURITY ≥90%
Synonyms
C06180 | FT-0625434 | KBioGR_002463 | ( inverted exclamation markA) Anabasine | KBioSS_000383 | PHENYLTHIOHYDANTOIN-ASPARTICACID | FT-0662140 | Prestwick1_000669 | Anabasine | Anabasine, (+/-) | E48D8A38-D352-4AA3-BCCF-B14E46A0556C | STK028316 | MLS000737
Storage
Store at 2-8°C
Shipped In
Wet ice
★
Size
USA
독일 (EU)*
Price
Qty
50mg
A493484-50mg
3 재고 있음
—
US$88.90
250mg
A493484-250mg
3 재고 있음
—
US$264.90
1g
A493484-1g
2 재고 있음
—
US$953.90
5g
A493484-5g
2 재고 있음
—
US$3,972.90
Enter a quantity for the sizes you want to add.
🧪

Why this grade

≥90% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C Ships Wet ice 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

 A tobacco alkaloid, was used as a biomarker of active tobacco use.

Specifications

동의어
C06180 | FT-0625434 | KBioGR_002463 | ( inverted exclamation markA) Anabasine | KBioSS_000383 | PHENYLTHIOHYDANTOIN-ASPARTICACID | FT-0662140 | Prestwick1_000669 | Anabasine | Anabasine, (+/-) | E48D8A38-D352-4AA3-BCCF-B14E46A0556C | STK028316 | MLS000737
사양 및 순도
≥90%
생화학 및 생리적 메커니즘
Nicotinic receptor agonists. Use as a biomarker for activated tobacco use. Inhibits the conversion of androstenedione to estrogen in a dose-dependent manner.
보관 조건
Store at 2-8°C
배송
Wet ice
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순수함
≥90%
이름과 식별자
Pubchem Sid504750537
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504750537
정식 스마일C1CCNC(C1)C2=CN=CC=C2
IUPAC Name3-piperidin-2-ylpyridine
InChIKeyMTXSIJUGVMTTMU-UHFFFAOYSA-N
INCHI1S/C10H14N2/c1-2-7-12-10(5-1)9-4-3-6-11-8-9/h3-4,6,8,10,12H,1-2,5,7H2
이성체 SMILES C1CCNC(C1)C2=CN=CC=C2
WGK 독일 3
RTECS UT7371000
분자량 162.23
Beilstein 82639
Reaxy-Rn 82639
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=82639&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
SuperclassAlkaloids and derivatives
분류Not available
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentAlkaloids and derivatives
Alternative Parents Aralkylamines  Pyridines and derivatives  Piperidines  Heteroaromatic compounds  Dialkylamines  Azacyclic compounds  Organopnictogen compounds  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Alkaloid or derivatives - Aralkylamine - Pyridine - Piperidine - Heteroaromatic compound - Azacycle - Organoheterocyclic compound - Secondary amine - Secondary aliphatic amine - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Amine - Aromatic heteromonocyclic compound
설명This compound belongs to the class of organic compounds known as alkaloids and derivatives. These are naturally occurring chemical compounds that contain mostly basic nitrogen atoms. This group also includes some related compounds with neutral and even weakly acidic properties. Also some synthetic compounds of similar structure are attributed to alkaloids. In addition to carbon, hydrogen and nitrogen, alkaloids may also contain oxygen, sulfur and more rarely other elements such as chlorine, bromine, and phosphorus.
External Descriptors Pyridine alkaloids
3D 구조
상호 작용 화학 구조 모델





관련 대상(인간)
CHRNA7 Tchem Neuronal acetylcholine receptor subunit alpha-7 (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
ACHE Tclin Acetylcholinesterase (18204 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
POLB Tchem DNA polymerase beta (23632 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CHRNA7 Tchem Neuronal acetylcholine receptor protein alpha-7 subunit (3524 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HepG2 (196354 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
FEN1 Tchem Flap endonuclease 1 (12055 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
GNAS Tbio Guanine nucleotide-binding protein G(s), subunit alpha (103405 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
SMN1 Tchem Survival motor neuron protein (34246 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CHRNB2 Tclin Neuronal acetylcholine receptor; alpha4/beta2 (3972 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
관련 대상(비인간)
Musca domestica (713 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
rep Replicase polyprotein 1ab (378 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Chrna3 Neuronal acetylcholine receptor (756 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
nAChRalpha5 Nicotinic acetylcholine receptor alpha 5 subunit (134 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.

6 results found

Lot NumberCertificate Type날짜항목
L2210107Certificate of AnalysisSep 01, 2026 A493484
L2210119Certificate of AnalysisSep 01, 2026 A493484
L2210120Certificate of AnalysisSep 01, 2026 A493484
L2210121Certificate of AnalysisSep 01, 2026 A493484
B2527061Certificate of AnalysisDec 21, 2022 A493484
C2504081Certificate of AnalysisDec 21, 2022 A493484
화학 및 물리적 특성
굴절률1.544
발화점(°F)199°F
발화점(°C)93°C
끓는점(°C)270-272°C
녹는점(°C)9°C
분자량162.230 g/mol
XLogP31.000
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass162.116 Da
Monoisotopic Mass162.116 Da
Topological Polar Surface Area24.900 Ų
Heavy Atom Count12
Formal Charge0
Complexity136.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
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