 Home > Encyclopedia > 2-amino-4-[4-(2-amino-2-carboxyethyl)-1-[5-amino-5-carboxy-2-[(3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypentyl]-5-hydroxypyridin-1-ium-3-yl]butanoate

2-amino-4-[4-(2-amino-2-carboxyethyl)-1-[5-amino-5-carboxy-2-[(3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypentyl]-5-hydroxypyridin-1-ium-3-yl]butanoate

2-amino-4-[4-(2-amino-2-carboxyethyl)-1-[5-amino-5-carboxy-2-[(3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypentyl]-5-hydroxypyridin-1-ium-3-yl]butanoate structure

CAS No:
87672-07-9
Formula:
C24H38N4O13
Chemical Name:
2-amino-4-[4-(2-amino-2-carboxyethyl)-1-[5-amino-5-carboxy-2-[(3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypentyl]-5-hydroxypyridin-1-ium-3-yl]butanoate
Synonyms:
galactosylpyridinoline;pyridinoline galactoside;Galactosylpyridinoline;Pyridinoline galactoside;87672-07-9;2-amino-4-[4-(2-amino-2-carboxyethyl)-1-[5-amino-5-carboxy-2-[(3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypentyl]-5-hydroxypyridin-1-ium-3-yl]butanoate;Pyridinium, 4-(2-amino-2-carboxyethyl)-1-(5-amino-5-carboxy-2-(galactosyloxy)pentyl)-3-(3-amino-3-carboxypropyl)-5-hydroxy-, hydroxide, inner salt

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2-amino-4-[4-(2-amino-2-carboxyethyl)-1-[5-amino-5-carboxy-2-[(3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypentyl]-5-hydroxypyridin-1-ium-3-yl]butanoate Basic Attributes

Molecular Weight：

590.6 g/mol

Exact Mass：

590.24353728 g/mol

Characteristics

PSA：

316 Å²

Drug Information

MeSH Entry Terms：

galactosylpyridinoline

Computed Properties

Molecular Weight:590.6
XLogP3:-10.2
Hydrogen Bond Donor Count:10
Hydrogen Bond Acceptor Count:16
Rotatable Bond Count:15
Exact Mass:590.24353728
Monoisotopic Mass:590.24353728
Topological Polar Surface Area:316
Heavy Atom Count:41
Complexity:864
Defined Atom Stereocenter Count:4
Undefined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-amino-4-[4-(2-amino-2-carboxyethyl)-1-[5-amino-5-carboxy-2-[(3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypentyl]-5-hydroxypyridin-1-ium-3-yl]butanoate

Basic Attributes
Characteristics
Drug Information
Computed Properties

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