75139-06-9
Product Name:
5-hydroxy-4-[(2S)-2-[(1R,2S,6R)-2-[(E)-3-hydroxy-2-[(2R,3R,6S)-6-[(E,3S)-3-[(3S,5R)-5-[(1S)-1-methoxyethyl]-3-methyl-oxolan-2-yl]but-1-enyl]-3-methyl-oxan-2-yl]prop-1-enyl]-6-methyl-cyclohexyl]propanoyl]furan-3-one
Formula:
C35H54O8
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COMPUTED DESCRIPTORS
Molecular Weight | 602.8 g/mol |
---|---|
XLogP3 | 6.8 |
Hydrogen Bond Donor Count | 2 |
Hydrogen Bond Acceptor Count | 8 |
Rotatable Bond Count | 10 |
Exact Mass | 602.38186868 g/mol |
Monoisotopic Mass | 602.38186868 g/mol |
Topological Polar Surface Area | 112 Ų |
Heavy Atom Count | 43 |
Formal Charge | 0 |
Complexity | 1080 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 12 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 3 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Tetronasin is a natural product found in Streptomyces longisporoflavus with data available.