(1R,2R,4aS,6aR,6aS,6bR,10R,11R,12aR,14bR)-11-acetyloxy-1,10-dihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
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(1R,2R,4aS,6aR,6aS,6bR,10R,11R,12aR,14bR)-11-acetyloxy-1,10-dihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
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CAS No:
97094-22-9
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Formula:
C32H50O6
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Chemical Name:
(1R,2R,4aS,6aR,6aS,6bR,10R,11R,12aR,14bR)-11-acetyloxy-1,10-dihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
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Synonyms:
97094-22-9;2-Acetyltormentic acid;SCHEMBL12474858;DTXSID70914185;Urs-12-en-28-oic Acid, 2-(acetyloxy)-3,19-dihydroxy-, (2alpha,3beta)-;2-(Acetyloxy)-3,19-dihydroxyurs-12-en-28-oic acid
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CAS No:
(1R,2R,4aS,6aR,6aS,6bR,10R,11R,12aR,14bR)-11-acetyloxy-1,10-dihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid Basic Attributes
530.7 g/mol
530.36073931 g/mol
Computed Properties
Molecular Weight:530.7
XLogP3:5.5
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:530.36073931
Monoisotopic Mass:530.36073931
Topological Polar Surface Area:104
Heavy Atom Count:38
Complexity:1060
Defined Atom Stereocenter Count:10
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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