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griffonilide

CAS No.:
61371-55-9
Catalog Number:
AG00EDIO
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00EDIO
Chemical Name:
griffonilide
CAS Number:
61371-55-9
MDL Number:
MFCD20527291
IUPAC Name:
(6R,7S,7aS)-6,7-dihydroxy-7,7a-dihydro-6H-1-benzofuran-2-one
InChI:
InChI=1S/C8H8O4/c9-5-2-1-4-3-6(10)12-8(4)7(5)11/h1-3,5,7-9,11H/t5-,7+,8+/m1/s1
InChI Key:
VXWUBYBAUIHOHG-DTLFHODZSA-N
Properties
Complexity:
279  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
3  
Defined Bond Stereocenter Count:
0
Exact Mass:
168.042g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
168.148g/mol
Monoisotopic Mass:
168.042g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.1  
Literature
Title Journal
Tylosema esculentum extractives and their bioactivity. Bioorganic & medicinal chemistry 20110901
Properties