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6918-49-6

6918-49-6 structural image
Product Name: (2S,3R,E)-2-Amino-4-icosene-1,3-diol
Formula: C20H41NO2
Synonyms: (2S,3R,4E)-4-Icosasphingenine;trans-D-erythro-2-Amino-4-eicosene-1,3-diol;D-erythro-Sphingosine (d20:1);D-erythro-Sphingosine C-20;20-Carbon-sphingosine
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COMPUTED DESCRIPTORS

Molecular Weight 327.5 g/mol
XLogP3 6.4
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 17
Exact Mass 327.313729551 g/mol
Monoisotopic Mass 327.313729551 g/mol
Topological Polar Surface Area 66.5 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 256
Isotope Atom Count 0
Defined Atom Stereocenter Count 2
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

C20 sphingosine is a sphingoid that is the C20 analogue of sphingosine. It has a role as a mouse metabolite. It is a sphingoid and an aminodiol. It is a conjugate base of a C20 sphingosine(1+).