3-alpha-O-acetyl-alpha-boswellic acid

Basic Information

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CAS Number

89913-60-0

Molecular Formula

C32H50O4

Molecular Weight

498.74 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Surfactants Anionic Surfactants

Polymers and Plastics Thermoplastics Polyolefins

Basic Physical Properties

Physical State

Powder

Melting Point

230-232 ºC

Density

1.10

Solubility

Methanol,Ethyl Acetate,Dichloromethane,DMSO

SMILES

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CC(=O)OC1CCC2(C(C1(C)C(=O)O)CCC3(C2CC=C4C3(CCC5(C4CC(CC5)(C)C)C)C)C)C

InChI

InChI=1S/C32H50O4/c1-20(33)36-25-12-13-29(5)23-10-9-21-22-19-27(2,3)15-16-28(22,4)17-18-30(21,6)31(23,7)14-11-24(29)32(25,8)26(34)35/h9,22-25H,10-19H2,1-8H3,(H,34,35)/t22-,23+,24+,25+,28+,29+,30+,31+,32+/m0/s1

InChIKey

IAWGZKRQDHPFCZ-OBHGTAHRSA-N

LogP

7.80440000000001

Topological Polar Surface Area

63.60000000000001 Å²

Hydrogen Bond Donor/Acceptor

1 / 4

Complexity

996

Safety Information

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Storage Conditions

2-8℃

Synonyms & References

English

Olean-12-en-23-oic acid, 3-(acetyloxy)-, (3α,4β)-
alpha-boswellic acid,3-acetyl
(3alpha,4beta)-3-(Acetyloxy)olean-12-en-23-oic acid
(3R,4R,4aR,6aR,6bS,8aR,12aR,14aR,14bR)-3-acetyloxy-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-4-carboxylic acid
3-ACETYL-ALPHA-BOSWELLIC ACID
3-O-Acetyl-α-boswellic acid
ACETYL-a-BOSWELLIC ACID, 3-(P)
alpha-Acetylboswellic acid
(3α,4β)-3-(Acetyloxy)olean-12-en-23-oic acid
3α-(Acetyloxy)olean-12-en-24-oic acid
alpha-Boswellic acid acetate
3α-acetyl-α-boswellic acid
(3α,4β)-3-(Acetyloxy)olean-12-en-23-oic acid (ACI)
Acetyl-α-boswellic acid
α-Boswellic acid acetate
α-Boswellic acid acetate,3-O-Acetyl-α-boswellic acid,Acetyl-α-boswellic acid
Acetyl-alpha-Boswellig acid
Olean-12-en-23-oic acid, 3-(acetyloxy)-, (3a,4ss)-; (3a,4ss)-3-(Acetyloxy)olean-12-en-23-oic acid; 3-O-Acetyl-a-boswellic acid; Acetyl-a-boswellic acid; a-Boswellic acid acetate
-boswellic acid acetate
BDBM50531259
CS-0023057
DA-60276
3-O-Acetyl-alpha-boswellic acid
ACETYL-.ALPHA.-BOSWELLIC ACID
3-alpha-O-acetyl-alpha-boswellic acid
DTXSID80569721
OLEAN-12-EN-23-OIC ACID, 3-(ACETYLOXY)-, (3.ALPHA.,4.BETA.)-
(3.ALPHA.,4.BETA.)-3-(ACETYLOXY)OLEAN-12-EN-23-OIC ACID
CHEMBL1802044
UNII-BIO9XQ683U
(3,4)-3-(Acetyloxy)olean-12-en-23-oic acid; 3-O-Acetyl--boswellic acid; Acetyl--boswellic acid

MDL Number

MFCD03788772

FAQ

What are the physical and chemical properties of 3-alpha-O-acetyl-alpha-boswellic acid (CAS: 89913-60-0)?

3-alpha-O-acetyl-alpha-boswellic acid (CAS: 89913-60-0) is a crystalline solid with a molecular weight of approximately 455.44 g/mol. It has a low solubility in water but is soluble in organic solvents such as methanol and ethanol. It is moderately reactive, particularly with bases and reducing agents.

How is 3-alpha-O-acetyl-alpha-boswellic acid (CAS: 89913-60-0) typically synthesized?

3-alpha-O-acetyl-alpha-boswellic acid is typically synthesized through a multi-step process involving the acetylation of alpha-boswellic acid. The reaction is catalyzed by a strong acid like triflic acid, with a high selectivity and yield, often around 80-90%.

What industries use 3-alpha-O-acetyl-alpha-boswellic acid (CAS: 89913-60-0)?

3-alpha-O-acetyl-alpha-boswellic acid (CAS: 89913-60-0) is primarily used in the pharmaceutical industry for its anti-inflammatory and analgesic properties. It is also explored for its potential applications in cosmetics and dietary supplements.

What precautions should be taken when handling 3-alpha-O-acetyl-alpha-boswellic acid (CAS: 89913-60-0)?

When handling 3-alpha-O-acetyl-alpha-boswellic acid (CAS: 89913-60-0), it is important to use appropriate personal protective equipment (PPE) such as gloves and goggles. Ensure adequate ventilation and work in a fume hood. In case of spill, neutralize with an appropriate solution and dispose of according to local regulations. Always refer to the safety data sheet (SDS) for detailed safety information.