 Home > Encyclopedia > 7-[[6-Deoxy-3-O-(6-deoxy-α-L-mannopyranosyl)-α-L-mannopyranosyl]oxy]-3-[(6-O-β-D-galactopyranosyl-β-D-glucopyranosyl)oxy]-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one

7-[[6-Deoxy-3-O-(6-deoxy-α-L-mannopyranosyl)-α-L-mannopyranosyl]oxy]-3-[(6-O-β-D-galactopyranosyl-β-D-glucopyranosyl)oxy]-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one

7-[[6-Deoxy-3-O-(6-deoxy-α-L-mannopyranosyl)-α-L-mannopyranosyl]oxy]-3-[(6-O-β-D-galactopyranosyl-β-D-glucopyranosyl)oxy]-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one structure

CAS No:
81944-31-2
Formula:
C39H50O24
Chemical Name:
7-[[6-Deoxy-3-O-(6-deoxy-α-L-mannopyranosyl)-α-L-mannopyranosyl]oxy]-3-[(6-O-β-D-galactopyranosyl-β-D-glucopyranosyl)oxy]-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
Synonyms:
4H-1-Benzopyran-4-one,7-[[6-deoxy-3-O-(6-deoxy-α-L-mannopyranosyl)-α-L-mannopyranosyl]oxy]-3-[(6-O-β-D-galactopyranosyl-β-D-glucopyranosyl)oxy]-5-hydroxy-2-(4-hydroxyphenyl)-;7-[[6-Deoxy-3-O-(6-deoxy-α-L-mannopyranosyl)-α-L-mannopyranosyl]oxy]-3-[(6-O-β-D-galactopyranosyl-β-D-glucopyranosyl)oxy]-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one;Melitin

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7-[[6-Deoxy-3-O-(6-deoxy-α-L-mannopyranosyl)-α-L-mannopyranosyl]oxy]-3-[(6-O-β-D-galactopyranosyl-β-D-glucopyranosyl)oxy]-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one Basic Attributes

Molecular Weight：

902.805

Exact Mass：

902.80

Characteristics

PSA：

383

XLogP3：

-3.8

Drug Information

MeSH Entry Terms：

Brucella melitensis M antigen

Computed Properties

Molecular Weight:902.8
XLogP3:-3.8
Hydrogen Bond Donor Count:14
Hydrogen Bond Acceptor Count:24
Rotatable Bond Count:11
Exact Mass:902.26920246
Monoisotopic Mass:902.26920246
Topological Polar Surface Area:383
Heavy Atom Count:63
Complexity:1570
Undefined Atom Stereocenter Count:20
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 7-[[6-Deoxy-3-O-(6-deoxy-α-L-mannopyranosyl)-α-L-mannopyranosyl]oxy]-3-[(6-O-β-D-galactopyranosyl-β-D-glucopyranosyl)oxy]-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one

Basic Attributes
Characteristics
Drug Information
Computed Properties

7-[[6-Deoxy-3-O-(6-deoxy-α-L-mannopyranosyl)-α-L-mannopyranosyl]oxy]-3-[(6-O-β-D-galactopyranosyl-β-D-glucopyranosyl)oxy]-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one

SDS

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