 Home > Encyclopedia > N-[(E,2S,3R)-3-hydroxy-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoctadec-4-en-2-yl]-10-pyren-1-yldecanamide

N-[(E,2S,3R)-3-hydroxy-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoctadec-4-en-2-yl]-10-pyren-1-yldecanamide

N-[(E,2S,3R)-3-hydroxy-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoctadec-4-en-2-yl]-10-pyren-1-yldecanamide structure

CAS No:
110668-37-6
Formula:
C50H73NO8
Chemical Name:
N-[(E,2S,3R)-3-hydroxy-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoctadec-4-en-2-yl]-10-pyren-1-yldecanamide
Synonyms:
Pyrglccer; N-(10-(1-Pyrenyl)decanoyl)glucocerebroside;
Categories:
Biochemical Engineering > Saccharides

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N-[(E,2S,3R)-3-hydroxy-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoctadec-4-en-2-yl]-10-pyren-1-yldecanamide Basic Attributes

Molecular Weight：

816.11700

Exact Mass：

815.53361829

Characteristics

PSA：

152.20000

XLogP3：

10.00710

Density：

1.17g/cm3

Boiling Point：

977.6ºC at 760mmHg

Flash Point：

545ºC

Refractive Index：

1.613

Vapor Pressure：

0mmHg at 25°C

Drug Information

MeSH Entry Terms：

N-(10-(1-pyrenyl)decanoyl)glucocerebroside

Computed Properties

Molecular Weight:816.1
XLogP3:12.6
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:29
Exact Mass:815.53361829
Monoisotopic Mass:815.53361829
Topological Polar Surface Area:149
Heavy Atom Count:59
Complexity:1170
Defined Atom Stereocenter Count:7
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-[(E,2S,3R)-3-hydroxy-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoctadec-4-en-2-yl]-10-pyren-1-yldecanamide

Basic Attributes
Characteristics
Drug Information
Computed Properties
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