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80394-65-6

80394-65-6 structural image
Product Name: cationomycin
Formula: C45H70O15
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COMPUTED DESCRIPTORS

Molecular Weight 851.0 g/mol
XLogP3 5.6
Hydrogen Bond Donor Count 5
Hydrogen Bond Acceptor Count 15
Rotatable Bond Count 14
Exact Mass 850.47147152 g/mol
Monoisotopic Mass 850.47147152 g/mol
Topological Polar Surface Area 209 Ų
Heavy Atom Count 60
Formal Charge 0
Complexity 1530
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 18
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

2-Hydroxy-4-[7-hydroxy-2-[5-[5-[5-(1-hydroxypropyl)-3,5-dimethyloxolan-2-yl]-3-methyloxolan-2-yl]-4-methoxy-5-methyloxolan-2-yl]-2,8-dimethyl-1,10-dioxaspiro[4.5]decan-9-yl]-3-(2-hydroxy-4-methoxy-6-methylbenzoyl)oxy-2-methylpentanoic acid is a natural product found in Actinomadura with data available.