Marrubiin

Modify Date: 2026-07-02 00:04:31

Marrubiin Structure
Marrubiin structure
Common Name Marrubiin
CAS Number 465-92-9 Molecular Weight 332.43400
Density 1.152g/cm3 Boiling Point 465.2ºC at 760mmHg
Molecular Formula C20H28O4 Melting Point 159-162ºC
MSDS N/A Flash Point 235.2ºC

 Use of Marrubiin


Marrubiin, isolated from Marrubium vulgare, exhibits vasorelaxant and antioedematogenic activity. Marrubiin alleviates diabetic symptoms in animals[1][2][3].

 Names

Name marrubiin
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.152g/cm3
Boiling Point 465.2ºC at 760mmHg
Melting Point 159-162ºC
Molecular Formula C20H28O4
Molecular Weight 332.43400
Flash Point 235.2ºC
Exact Mass 332.19900
PSA 59.67000
LogP 3.72120
Vapour Pressure 1.87E-09mmHg at 25°C
Index of Refraction 1.537
InChIKey HQLLRHCTVDVUJB-OBHOOXMTSA-N
SMILES CC1CC2OC(=O)C3(C)CCCC(C)(C23)C1(O)CCc1ccoc1

 Safety Information

Risk Phrases 25
Safety Phrases 1-22-45
RIDADR UN 2811

 MarrubiinBioassay

View more

Name: Antibacterial activity against Staphylococcus aureus MRSA ATCC 43300 (CO-ADD:GP_020);...
Source: ChEMBL
Target: Staphylococcus aureus
External Id: CHEMBL4296192
Name: Antibacterial activity against Escherichia coli ATCC 25922 (CO-ADD:GN_001); MIC in CA...
Source: ChEMBL
Target: Escherichia coli
External Id: CHEMBL4296783
Name: Antibacterial activity against Acinetobacter baumannii ATCC 19606 (CO-ADD:GN_034); MI...
Source: ChEMBL
Target: Acinetobacter baumannii
External Id: CHEMBL4296193
Name: Antibacterial activity against Pseudomonas aeruginosa ATCC 27853 (CO-ADD:GN_042); MIC...
Source: ChEMBL
Target: Pseudomonas aeruginosa
External Id: CHEMBL4296187
Name: Antifungal activity against Cryptococcus neoformans H99 ATCC 208821 (CO-ADD:FG_002); ...
Source: ChEMBL
Target: Cryptococcus neoformans
External Id: CHEMBL4296190
Name: Antifungal activity against Candida albicans ATCC 90028 (CO-ADD:FG_001); MIC in YNB m...
Source: ChEMBL
Target: Candida albicans
External Id: CHEMBL4296189
Name: NCI human tumor cell line growth inhibition assay. Data for the MCF7 Non-Small Cell L...
Source: DTP/NCI
Target: N/A
External Id: MCF7_OneDose
Name: Antibacterial activity against Klebsiella pneumoniae MDR ATCC 70063 (CO-ADD:GN_003); ...
Source: ChEMBL
Target: Klebsiella pneumoniae
External Id: CHEMBL4296186
Total 8, Current Page 1 of 1
1

 Synonyms

Marrubiin I
MarrubiuM bitter
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