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99260-67-0

99260-67-0 structural image
Product Name: saquayamycin B
Formula: C43H48O16
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COMPUTED DESCRIPTORS

Molecular Weight 820.8 g/mol
XLogP3 1.4
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 16
Rotatable Bond Count 5
Exact Mass 820.29423544 g/mol
Monoisotopic Mass 820.29423544 g/mol
Topological Polar Surface Area 220 Ų
Heavy Atom Count 59
Formal Charge 0
Complexity 1890
Isotope Atom Count 0
Defined Atom Stereocenter Count 15
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

(3R,4aR,12bS)-9-[(1R,3R,5S,8S,10R,12R,14R)-5,14-dimethyl-6-oxo-2,4,9,13-tetraoxatricyclo[8.4.0.03,8]tetradecan-12-yl]-4a,8,12b-trihydroxy-3-methyl-3-[(2S,5S,6S)-6-methyl-5-[[(2R,6S)-6-methyl-5-oxo-2H-pyran-2-yl]oxy]oxan-2-yl]oxy-2,4-dihydrobenzo[a]anthracene-1,7,12-trione is a natural product found in Streptomyces and Streptomyces nodosus with data available.