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111149-94-1

111149-94-1 structural image
Product Name: 7-EPI-10-DEACETYL-TAXOL
Formula: C45H49NO13
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COMPUTED DESCRIPTORS

Molecular Weight 811.9 g/mol
XLogP3 1.9
Hydrogen Bond Donor Count 5
Hydrogen Bond Acceptor Count 13
Rotatable Bond Count 12
Exact Mass 811.32039062 g/mol
Monoisotopic Mass 811.32039062 g/mol
Topological Polar Surface Area 215 Ų
Heavy Atom Count 59
Formal Charge 0
Complexity 1680
Isotope Atom Count 0
Defined Atom Stereocenter Count 11
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

7-Epi-10-deacetyltaxol is a natural product found in Taxus cuspidata with data available.