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22738-98-3

22738-98-3 structural image
Product Name: ILICICOLIN F
Formula: C25H31ClO6
Synonyms: 8′-Acetoxyascochlorin;Acetoxy-ascochlorin;Antibiotic LL-Z 1272 ζ;Benzaldehyde, 3-[(2E,4E)-5-[(1S,2S,3S,6R)-3-(acetyloxy)-1,2,6-trimethyl-5-oxocyclohexyl]-3-methyl-2,4-pentadien-1-yl]-5-chloro-2,4-dihydroxy-6-methyl
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COMPUTED DESCRIPTORS

Molecular Weight 463.0 g/mol
XLogP3 5.8
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 7
Exact Mass 462.1809164 g/mol
Monoisotopic Mass 462.1809164 g/mol
Topological Polar Surface Area 101 Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 776
Isotope Atom Count 0
Defined Atom Stereocenter Count 4
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 2
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Ilicicolin F is a natural product found in Neonectria ditissima with data available.

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