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27495-40-5

27495-40-5 structural image
Product Name: (3S,5S)-5-[(1S,2Z,3aβ,10aα,10bα)-Decahydro-2-(2,5-dihydro-3-methoxy-4-methyl-5-oxofuran-2-ylidene)-1α-methyl-2H-furo[3,2-c]pyrrolo[1,2-a]azepin-8α-yl]-4,5-dihydro-3-methylfuran-2(3H)-one
Formula: C23H31NO6
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COMPUTED DESCRIPTORS

Molecular Weight 417.5 g/mol
XLogP3 3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 2
Exact Mass 417.21513771 g/mol
Monoisotopic Mass 417.21513771 g/mol
Topological Polar Surface Area 74.3 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 832
Isotope Atom Count 0
Defined Atom Stereocenter Count 7
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

Protostemonine is an alkaloid. It has a role as a metabolite.