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10376-50-8

10376-50-8 structural image
Product Name: 3BETA-ACETOXYBETULINIC ACID
Formula: C32H50O4
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COMPUTED DESCRIPTORS

Molecular Weight 498.7 g/mol
XLogP3 8.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 4
Exact Mass 498.37091007 g/mol
Monoisotopic Mass 498.37091007 g/mol
Topological Polar Surface Area 63.6 Ų
Heavy Atom Count 36
Formal Charge 0
Complexity 967
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 10
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

9-Acetyloxy-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]chrysene-3a-carboxylic acid is a natural product found in Eucalyptus globulus, Monascus purpureus, and other organisms with data available.