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Structure

3-Acetyl-beta-boswellic acid

CAS
5968-70-7
Catalog Number
ACM5968707
Category
Other Products
Molecular Weight
498.74
Molecular Formula
C32H50O4

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Specification

Synonyms
ACETYL-B-BOSWELLIC ACID, 3-;3-ACETYL-BETA-BOSWELLIC ACID;BETA-ACETYLBOSWELLIC ACID;BOSWELLIC ACID, 3-ACETYL;3-Acetyl-(-boswellicacid;3-O-Acetyl--boswellicacid,Boswelliasp;3-O-ACETYL-BOSWELLIC ACID, BOSWELLIA SP, >98%;B-ACETYLBOSWELLIC ACID
IUPAC Name
(3R,4R,4aR,6aR,6bS,8aR,11R,12S,12aR,14aR,14bR)-3-acetyloxy-4,6a,6b,8a,11,12,14b-heptamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picene-4-carboxylic acid
Canonical SMILES
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C(=O)O)OC(=O)C)C)C)C2C1C)C)C
InChI Key
YJBVHJIKNLBFDX-MQURJEHKSA-N
Boiling Point
566.8ºC at 760 mmHg
Melting Point
157-161ºC
Flash Point
171.4ºC
Density
1.09g/cm³
Appearance
White to off-white solid
EC Number
611-863-3
Exact Mass
498.37100
H-Bond Acceptor
4
H-Bond Donor
1
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