CAS 13159-28-9|Betulinaldehyde

Introduction：Basic information about CAS 13159-28-9|Betulinaldehyde, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

Table of Contents

1. Names
2. Betulinaldehyde BiologicalActivity
3. Chemical & Physical Properties
4. Synonyms

Common Name	Betulinaldehyde
CAS Number	13159-28-9	Molecular Weight	440.701
Density	1.0±0.1 g/cm3	Boiling Point	513.9±33.0 °C at 760 mmHg
Molecular Formula	C₃₀H₄₈O₂	Melting Point	/
MSDS	/	Flash Point	217.4±18.0 °C

Names

Name	Betulinicaldehyde
Synonym	More Synonyms

Betulinaldehyde BiologicalActivity

Description	Betulinaldehyde(Betunal) belongs to pentacyclic triterpenoids and was reported to exhibit antimicrobial activities against bacteria and fungi, including S. aureus.IC50 value:Target: Betulinaldehyde(Betunal) belongs to pentacyclic triterpenoids that are based on a 30-carbon skeleton comprising four six-membered rings and one five-membered ring. Betulinaldehyde regulates multiple desirable targets which could be further explored in the development of therapeutic agents for the treatment of S. aureus infections [1]. Study compounds α-amyrin [3β-hydroxy-urs-12-en-3-ol (AM)], betulinic acid [3β-hydroxy-20(29)-lupaene-28-oic acid (BA)] and betulinaldehyde [3β-hydroxy-20(29)-lupen-28-al (BE)] belong to pentacyclic triterpenoids and were reported to exhibit antimicrobial activities against bacteria and fungi, including S. aureus. The MIC values of these compounds against a reference strain of methicillin-resistant S. aureus (MRSA) (ATCC 43300) ranged from 64 μg/ml to 512 μg/ml. However, the response mechanisms of S. aureus to these compounds are still poorly understood [2].
Related Catalog	Signaling Pathways >>Anti-infection >>BacterialResearch Areas >>InfectionNatural Products >>Terpenoids and Glycosides
References	[1]. Chung PY, et al. Identification, by gene expression profiling analysis, of novel gene targets in Staphylococcus aureus treated with betulinaldehyde. Res Microbiol. 2013 May;164(4):319-26. [2]. Chung PY, et al. Transcriptional profiles of the response of methicillin-resistant Staphylococcus aureus to pentacyclic triterpenoids. PLoS One. 2013;8(2):e56687.

Description

Betulinaldehyde(Betunal) belongs to pentacyclic triterpenoids and was reported to exhibit antimicrobial activities against bacteria and fungi, including S. aureus.IC50 value:Target: Betulinaldehyde(Betunal) belongs to pentacyclic triterpenoids that are based on a 30-carbon skeleton comprising four six-membered rings and one five-membered ring. Betulinaldehyde regulates multiple desirable targets which could be further explored in the development of therapeutic agents for the treatment of S. aureus infections [1]. Study compounds α-amyrin [3β-hydroxy-urs-12-en-3-ol (AM)], betulinic acid [3β-hydroxy-20(29)-lupaene-28-oic acid (BA)] and betulinaldehyde [3β-hydroxy-20(29)-lupen-28-al (BE)] belong to pentacyclic triterpenoids and were reported to exhibit antimicrobial activities against bacteria and fungi, including S. aureus. The MIC values of these compounds against a reference strain of methicillin-resistant S. aureus (MRSA) (ATCC 43300) ranged from 64 μg/ml to 512 μg/ml. However, the response mechanisms of S. aureus to these compounds are still poorly understood [2].

Related Catalog

Signaling Pathways >>Anti-infection >>BacterialResearch Areas >>InfectionNatural Products >>Terpenoids and Glycosides

References

[1]. Chung PY, et al. Identification, by gene expression profiling analysis, of novel gene targets in Staphylococcus aureus treated with betulinaldehyde. Res Microbiol. 2013 May;164(4):319-26.

[2]. Chung PY, et al. Transcriptional profiles of the response of methicillin-resistant Staphylococcus aureus to pentacyclic triterpenoids. PLoS One. 2013;8(2):e56687.

Chemical & Physical Properties

Density	1.0±0.1 g/cm3
Boiling Point	513.9±33.0 °C at 760 mmHg
Molecular Formula	C₃₀H₄₈O₂
Molecular Weight	440.701
Flash Point	217.4±18.0 °C
Exact Mass	440.365417
PSA	37.30000
LogP	9.07
Vapour Pressure	0.0±3.0 mmHg at 25°C
Index of Refraction	1.545
InChIKey	FELCJAPFJOPHSD-ROUWMTJPSA-N
SMILES	C=C(C)C1CCC2(C=O)CCC3(C)C(CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C12
Storage condition	-20°C

Synonyms

Lup-20(29)-en-28-al, 3β-hydroxy-

Lup-20(29)-en-28-al, 3-hydroxy-, (3β)-

(1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-9-hydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carbaldehyde

(1R,3aS,4S,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-9-Hydroxy-1-isopropenyl-5a,5b,8,8,11a-pentamethyl-eicosahydro-cyclopenta[a]chrysene-3a-carbaldehyde

(3β)-3-Hydroxylup-20(29)-en-28-al

Betulinaldehyde

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