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27570-20-3

27570-20-3 structural image
Product Name: Betulin-3-acetate
Formula: C32H52O3
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COMPUTED DESCRIPTORS

Molecular Weight 484.8 g/mol
XLogP3 8.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 4
Exact Mass 484.39164552 g/mol
Monoisotopic Mass 484.39164552 g/mol
Topological Polar Surface Area 46.5 Ų
Heavy Atom Count 35
Formal Charge 0
Complexity 891
Isotope Atom Count 0
Defined Atom Stereocenter Count 10
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

[(1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-3a-(hydroxymethyl)-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]chrysen-9-yl] acetate is a natural product found in Rhododendron formosanum, Helicteres angustifolia, and other organisms with data available.

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