3-Acetyl-11-keto-ß-boswellic acid, min.98% (HPLC)

Name: 3-Acetyl-11-keto-ß-boswellic acid
Brand: Chempure
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CAS Number

67416-61-9

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IUPAC name	(3R,4R,4aR,6aR,6bS,8aR,11R,12S,12aR,14aR,14bS)-3-acetyloxy-4,6a,6b,8a,11,12,14b-heptamethyl-14-oxo-1,2,3,4a,5,6,7,8,9,10,11,12,12a,14a-tetradecahydropicene-4-carboxylic acid
inchi	InChI=1S/C32H48O5/c1-18-9-12-28(4)15-16-30(6)21(25(28)19(18)2)17-22(34)26-29(5)13-11-24(37-20(3)33)32(8,27(35)36)23(29)10-14-31(26,30)7/h17-19,23-26H,9-16H2,1-8H3,(H,35,36)/t18-,19+,23-,24-,25+,26-,28-,29+,30-,31-,32-/m1/s1
inchi key	HMMGKOVEOFBCAU-BCDBGHSCSA-N
molecular formula	C32H48O5
synonyms	AKBA 67416-61-9 3-acetyl-11-keto-beta-boswellic acid 3-O-Acetyl-11-keto-beta-Boswellic Acid AKBA cpd
Compound Description	3-Acetyl-11-keto-beta-boswellic acid is a triterpenoid. 3-Acetyl-11-keto-beta-boswellic acid has been reported in Boswellia sacra, Boswellia serrata, and Boswellia papyrifera with data available. See also: Indian frankincense .

Computed Properties

Molecular Weight:	512.7 g/mol
XLogP3:	7.2
Hydrogen Bond Donor Count:	1
Hydrogen Bond Acceptor Count:	5
Rotatable Bond Count:	3
Exact Mass:	512.35017463 Da
Monoisotopic Mass:	512.35017463 Da
Topological Polar Surface Area:	80.7 Å²
Heavy Atom Count:	37
Formal Charge:	0
Complexity:	1060
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	11
Undefined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
Covalently-Bonded Unit Count:	1
Compound Is Canonicalized:	Yes

hazard signal
hazard classes and categories	Not Classified
hazard statements	Not Classified Reported as not meeting GHS hazard criteria by 1 of 1 companies. For more detailed information, please visit ECHA C&L website.

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Product No: DT7930

3-Acetyl-11-keto-ß-boswellic acid, min.98% (HPLC)

Product No: DT7930

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