4H-1-Benzopyran-4-one,3-[[6-O-(6-deoxy-a-L-mannopyranosyl)-b-D-glucopyranosyl]oxy]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-


Chemical Name: 4H-1-Benzopyran-4-one,3-[[6-O-(6-deoxy-a-L-mannopyranosyl)-b-D-glucopyranosyl]oxy]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-
CAS Number: 153-18-4
Product Number: AG00HY3I(AGN-PC-0Q6IJL)
Synonyms:
MDL No:
Molecular Formula: C27H30O16
Molecular Weight: 610.5175

Identification/Properties


Computed Properties
Molecular Weight:
610.521g/mol
XLogP3:
-1.3
Hydrogen Bond Donor Count:
10
Hydrogen Bond Acceptor Count:
16
Rotatable Bond Count:
6
Exact Mass:
610.153g/mol
Monoisotopic Mass:
610.153g/mol
Topological Polar Surface Area:
266A^2
Heavy Atom Count:
43
Formal Charge:
0
Complexity:
1020
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
10
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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