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18472-36-1

18472-36-1 structural image
Product Name: DELTA5-AVENASTEROL
Formula: C29H48O
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Kovats Retention Index 3315 3318.4

COMPUTED DESCRIPTORS

Molecular Weight 412.7 g/mol
XLogP3 8.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 5
Exact Mass 412.370516150 g/mol
Monoisotopic Mass 412.370516150 g/mol
Topological Polar Surface Area 20.2 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 687
Isotope Atom Count 0
Defined Atom Stereocenter Count 8
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Isofucosterol is a 3beta-sterol consisting of stigmastan-3beta-ol with double bonds at positions 5 and 24(28). The double bond at postion 24(28) adopts a Z-configuration. It has a role as an animal metabolite, a plant metabolite, an algal metabolite and a marine metabolite. It is a 3beta-sterol, a 3beta-hydroxy-Delta(5)-steroid, a C29-steroid and a member of phytosterols. It derives from a hydride of a stigmastane.

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