Cytisine - Moligand™, ≥98% , CAS No.485-35-8

CAS: 485-35-8 Cat. No.: C107705 Molecular Weight: 190.24 EC Number: 207-616-0

1 Citations COA

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Cytisine - Moligand™, ≥98% CAS No(485-35-8) by Aladdin Scientific

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AVAILABLE TO ORDER

GRADE & PURITY Moligand™ ? ≥98%

Synonyms

(1R,9S)-7,11-diazatricyclo[7.3.1.0~2,7~]trideca-2,4-dien-6-one | HB2033 | s2287 | Cytisine ((+)-) | HMS2096N10 | HMS3414N03 | MLS002153916 | 1,5-Methano-8H-pyrido(1,2-a)(1,5)diazocin-8-one, 1,2,3,4,5,6-hexahydro-, (1R,5S)- | C5E | DB09028 | HMS3884L11 | N

Storage

Room temperature

Shipped In

Normal

Specifications Product Properties Names and Identifiers Documentation Advanced Data Taxonomic Classification 3D Structure Associated Targets(Human) Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Citations of This Product References Solution Calculators Reviews

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Why this grade

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

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Storage & shipping

Room temperature Ships Normal 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.

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Literature proof

Cited in 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms

(1R, 9S)-7, 11-diazatricyclo[7.3.1.0~2, 7~]trideca-2, 4-dien-6-one | HB2033 | s2287 | Cytisine ((+)-) | HMS2096N10 | HMS3414N03 | MLS002153916 | 1, 5-Methano-8H-pyrido(1, 2-a)(1, 5)diazocin-8-one, 1, 2, 3, 4, 5, 6-hexahydro-, (1R, 5S)- | C5E | DB09028 | HMS3884L11 | N

Specifications & Purity

Moligand™, ≥98%

Biochemical and Physiological Mechanisms

Potent, selective agonist at neuronal nicotinic receptors. Acts as a partial agonist at β 2 -containing nicotinic receptors. (K i values are 2 (α4β2), 5890 (α7), 480 (α3β4), 329 (α6/α4β4) and 492 nM (α1β1γδ)).

Storage

Room temperature

Shipped In

Normal

Grade

Moligand™

Note

Wherever possible, you should prepare and use solutions on the same day. However, if you need to make up stock solutions in advance, we recommend that you store the solution as aliquots in tightly sealed vials at -20°C. Generally, these will be useable for up to one month. Before use, and prior to opening the vial we recommend that you allow your product to equilibrate to room temperature for at least 1 hour. Toxic, refer to SDS for further information. Need more advice on solubility, usage and handling? Please visit our frequently asked questions (FAQ) page for more details.

Purity

≥98%

Product Properties

ALogP	0.2

Names and Identifiers

Pubchem Sid	504751918
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504751918
Canonical Smiles	C1C2CNCC1C3=CC=CC(=O)N3C2
IUPAC Name	(1R,9S)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one
InChIKey	ANJTVLIZGCUXLD-DTWKUNHWSA-N
INCHI	1S/C11H14N2O/c14-11-3-1-2-10-9-4-8(5-12-6-9)7-13(10)11/h1-3,8-9,12H,4-7H2/t8-,9+/m0/s1
Isomeric SMILES	C1[C@H]2CNC[C@@H]1C3=CC=CC(=O)N3C2
WGK Germany	3
RTECS	HA4025000
UN Number	2811
Molecular Weight	190.24
Reaxy-Rn	156877
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=156877&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

Kingdom Organic compounds
- Superclass Alkaloids and derivatives
  - Class Lupin alkaloids
    - Subclass Cytisine and derivatives

Kingdom	Organic compounds
Superclass	Alkaloids and derivatives
Class	Lupin alkaloids
Subclass	Cytisine and derivatives
Intermediate Tree Nodes	Not available
Direct Parent	Cytisine and derivatives
Alternative Parents	Pyridinones Aralkylamines Piperidines Heteroaromatic compounds Lactams Dialkylamines Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Cytisine - Aralkylamine - Pyridinone - Piperidine - Pyridine - Heteroaromatic compound - Lactam - Secondary aliphatic amine - Azacycle - Organoheterocyclic compound - Secondary amine - Amine - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as cytisine and derivatives. These are lupin alkaloids with a structure based on the cytisine skeleton, which is a tetracyclic ketone containing fused pyridine and piperidine rings that form pyrido[1,2a][1,5]diazocin-8-one.
External Descriptors	organic heterotricyclic compound - alkaloid - secondary amino compound - bridged compound - lactam
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

3D Structure

Associated Targets(Human)

CHRNA7 Tchem Neuronal acetylcholine receptor subunit alpha-7 (3 Activities)

Discover Target: CHRNA7

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

ACHE Tclin Acetylcholinesterase (18204 Activities)

Discover Target: ACHE

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

CHRNA7 Tchem Neuronal acetylcholine receptor protein alpha-7 subunit (3524 Activities)

Discover Target: CHRNA7

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

GBA1 Tclin Beta-glucocerebrosidase (14647 Activities)

Discover Target: GBA1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

CHRNA1 Tclin Acetylcholine receptor protein alpha chain (98 Activities)

Discover Target: CHRNA1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

CYP2D6 Tclin Cytochrome P450 2D6 (33882 Activities)

Discover Target: CYP2D6

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

CYP1A2 Tchem Cytochrome P450 1A2 (26471 Activities)

Discover Target: CYP1A2

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

CHRND Tclin Acetylcholine receptor protein delta chain (14 Activities)

Discover Target: CHRND

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

CYP2C9 Tchem Cytochrome P450 2C9 (32119 Activities)

Discover Target: CYP2C9

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

CYP2C19 Tchem Cytochrome P450 2C19 (29246 Activities)

Discover Target: CYP2C19

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

CYP3A4 Tclin Cytochrome P450 3A4 (53859 Activities)

Discover Target: CYP3A4

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

ACHN (49357 Activities)

Lot Number	Certificate Type	Date	Item
B2225301	Certificate of Analysis	Dec 12, 2025	C107705
B2225316	Certificate of Analysis	Dec 12, 2025	C107705
B2225387	Certificate of Analysis	Dec 12, 2025	C107705
K1820032	Certificate of Analysis	Sep 19, 2022	C107705
K1820031	Certificate of Analysis	Sep 19, 2022	C107705
H2521088	Certificate of Analysis	Dec 27, 2021	C107705

Solubility	Soluble in water; Soluble in Methanol,Ethanol; Slightly soluble in Benzene,Acetone
Specific Rotation[α]	-112° (C=1,EtOH)
Boil Point(°C)	218°C
Melt Point(°C)	155°C
Molecular Weight	190.240 g/mol
XLogP3	0.200
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	190.111 Da
Monoisotopic Mass	190.111 Da
Topological Polar Surface Area	32.299 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	332.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

Cytisine - Moligand™, ≥98% , CAS No.485-35-8

Why this grade

Storage & shipping

Quality documents

Literature proof

Specifications

Documentation

📋 Safety Data Sheet (SDS)

✅ Certificate of Analysis (COA)

📊 Datasheet

🔬 Specification Sheet

Advanced Data

Molarity Calculator

Dilution Calculator

Reconstitution Calculator

Customer Reviews

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