Solamargine - Moligand™, ≥98% , CAS No.20311-51-7

CAS: 20311-51-7 Cat. No.: S414343 Fórmula: C45H73NO15 Peso molecular: 868.06 Número CE: 110-061-6 PubChem CID: 73611
Disponível para encomenda
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
(-)-SOLAMARGINE | CCG-270542 | s9145 | .DELTA.-SOLANIGRINE | CHEBI:9185 | 8KG991E7BN | HY-N0069 | AS-75093 | Solamargin | Solamargine | UNII-8KG991E7BN | AKOS030526705 | NSC-407810 | Q3489126 | DB12700 | DTXSID00942456 | A-Solanigrine | NSC 407810 | (2S,3
Storage
Protected from light,Store at -20°C
Shipped In
Ice chest + Ice pads
★
Size
USA
Alemanha (EU)*
Price
Qty
1mg
S414343-1mg
2 Em stock
—
48,90US$
5mg
S414343-5mg
2 Em stock
—
105,90US$
25mg
S414343-25mg
Sob encomenda · 8–12 semanas
289,90US$
100mg
S414343-100mg
2 Em stock
—
655,90US$
Enter a quantity for the sizes you want to add.
🧪

Why this grade

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

🌡

Storage & shipping

Protected from light,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.

Visão geral

Information

Solamargine Solamargine, a bioactive steroidal alkaloid isolated from Solanum aculeastrum, induces potent, non-selective cytotoxicity and P-gp inhibition.

Specifications

Sinónimos
(-)-SOLAMARGINE | CCG-270542 | s9145 | .DELTA.-SOLANIGRINE | CHEBI:9185 | 8KG991E7BN | HY-N0069 | AS-75093 | Solamargin | Solamargine | UNII-8KG991E7BN | AKOS030526705 | NSC-407810 | Q3489126 | DB12700 | DTXSID00942456 | A-Solanigrine | NSC 407810 | (2S,3
Especificações e pureza
Moligand™, ≥98%
Mecanismos bioquímicos e fisiológicos
Solamargine, a bioactive steroidal alkaloid isolated from Solanum aculeastrum, induces potent, non-selective cytotoxicity and P-gp inhibition.
Condições de armazenamento de armazenamento
Protected from light,Store at -20°C
Enviado em
Ice chest + Ice pads
Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.
Grau
Moligand™
Tipo de ação
INHIBITOR
Pureza
≥98%
Nomes e identificadores
Pubchem Sid504754717
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504754717
Sorrisos canónicosCC1CCC2(C(C3C(O2)CC4C3(CCC5C4CC=C6C5(CCC(C6)OC7C(C(C(C(O7)CO)OC8C(C(C(C(O8)C)O)O)O)O)OC9C(C(C(C(O9)C)O)O)O)C)C)C)NC1
IUPAC Name(2S,3R,4R,5R,6S)-2-[(2R,3S,4S,5R,6R)-4-hydroxy-2-(hydroxymethyl)-6-[(1S,2S,4S,5'R,6R,7S,8R,9S,12S,13R,16S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-piperidine]-16-yl]oxy-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol
InChIKeyMBWUSSKCCUMJHO-ZGXDEBHDSA-N
INCHI1S/C45H73NO15/c1-19-9-14-45(46-17-19)20(2)30-28(61-45)16-27-25-8-7-23-15-24(10-12-43(23,5)26(25)11-13-44(27,30)6)57-42-39(60-41-36(53)34(51)32(49)22(4)56-41)37(54)38(29(18-47)58-42)59-40-35(52)33(50)31(48)21(3)55-40/h7,19-22,24-42,46-54H,8-18H2,1-6H3/t19-,20+,21+,22+,24+,25-,26+,27+,28+,29-,30+,31+,32+,33-,34-,35-,36-,37+,38-,39-,40+,41+,42-,43+,44+,45-/m1/s1
SMILES isoméricas C[C@@H]1CC[C@@]2([C@H]([C@H]3[C@@H](O2)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4CC=C6[C@@]5(CC[C@@H](C6)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O[C@H]8[C@@H]([C@@H]([C@H]([C@@H](O8)C)O)O)O)O)O[C@H]9[C@@H]([C@@H]([C@H]([C@@H](O9)C)O)O)O)C)C)C)NC1
PubChem CID 73611
Peso molecular 868.06

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
SuperclassLipids and lipid-like molecules
ClasseSteroids and steroid derivatives
SubclassSteroidal glycosides
Intermediate Tree Nodes Not available
Direct ParentSteroidal saponins
Alternative Parents Diterpene glycosides  Spirosolanes and derivatives  Oligosaccharides  Azasteroids and derivatives  Delta-5-steroids  Diterpenoids  O-glycosyl compounds  Azaspirodecane derivatives  Alkaloids and derivatives  Piperidines  Oxanes  Tetrahydrofurans  Hemiaminals  Secondary alcohols  Oxacyclic compounds  Acetals  Polyols  Dialkylamines  Azacyclic compounds  Organopnictogen compounds  Hydrocarbon derivatives  Primary alcohols  
Molecular FrameworkAliphatic heteropolycyclic compounds
Substituents Steroidal saponin - Diterpene glycoside - Spirosolane skeleton - Oligosaccharide - Diterpenoid - Steroidal alkaloid - Azasteroid - Delta-5-steroid - Terpene glycoside - O-glycosyl compound - Glycosyl compound - Azaspirodecane - Alkaloid or derivatives - Piperidine - Oxane - Tetrahydrofuran - Secondary alcohol - Hemiaminal - Azacycle - Oxacycle - Organoheterocyclic compound - Secondary amine - Polyol - Acetal - Secondary aliphatic amine - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organopnictogen compound - Alcohol - Organonitrogen compound - Organooxygen compound - Amine - Primary alcohol - Aliphatic heteropolycyclic compound
DescriçãoThis compound belongs to the class of organic compounds known as steroidal saponins. These are saponins in which the aglycone moiety is a steroid. The steroidal aglycone is usually a spirostane, furostane, spirosolane, solanidane, or curcubitacin derivative.
External Descriptors Steroidal alkaloids
Estrutura 3D
Modelo de Estrutura Química Interativa





Alvos associados (humanos)
K562 (73714 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
MCF7 (126967 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
A549 (127892 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HCT-116 (91556 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HepG2 (196354 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HeLa (62764 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Alvos associados (não humanos)
Hdac6 Histone deacetylase 6 (222 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mus musculus (284745 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Rattus norvegicus (775804 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
H9c2 (3506 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
rep Replicase polyprotein 1ab (378 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mecanismos de ação
Certificados(CoA,COO,BSE/TSE e Mapa de Análise)
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.

9 results found

Lot NumberCertificate TypeDataItem
G2623272Certificate of AnalysisJun 29, 2026 S414343
G2623273Certificate of AnalysisJun 29, 2026 S414343
G2623276Certificate of AnalysisJun 29, 2026 S414343
G2623277Certificate of AnalysisJun 29, 2026 S414343
K2222708Certificate of AnalysisSep 04, 2025 S414343
K2222724Certificate of AnalysisSep 04, 2025 S414343
K2222732Certificate of AnalysisSep 04, 2025 S414343
K2222711Certificate of AnalysisJun 08, 2022 S414343
L2417168Certificate of AnalysisJun 08, 2022 S414343
Propriedades químicas e físicas
SolubilidadeSolubility (25°C) In vitro DMSO: 100 mg/mL (115.19 mM);    
Sensibilidadeheat sensitive,light sensitive
Ponto de fusão (°C)200-203°C
Peso molecular868.100 g/mol
XLogP31.100
Hydrogen Bond Donor Count9
Hydrogen Bond Acceptor Count16
Rotatable Bond Count7
Exact Mass867.498 Da
Monoisotopic Mass867.498 Da
Topological Polar Surface Area238.000 Ų
Heavy Atom Count61
Formal Charge0
Complexity1610.000
Isotope Atom Count0
Defined Atom Stereocenter Count26
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Calculadoras de soluções
Revisões

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