Home Other Building Blocks (R)-Ketoprofen b-D-glucuronide

(R)-Ketoprofen b-D-glucuronide

CAS No.:
140148-25-0
Catalog Number:
AG009F9G
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG009F9G
Chemical Name:
(R)-Ketoprofen b-D-glucuronide
CAS Number:
140148-25-0
MDL Number:
MFCD31562846
IUPAC Name:
(2S,3S,4S,5R,6S)-6-[(2R)-2-(3-benzoylphenyl)propanoyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
InChI:
InChI=1S/C22H22O9/c1-11(13-8-5-9-14(10-13)15(23)12-6-3-2-4-7-12)21(29)31-22-18(26)16(24)17(25)19(30-22)20(27)28/h2-11,16-19,22,24-26H,1H3,(H,27,28)/t11-,16+,17+,18-,19+,22+/m1/s1
InChI Key:
PBTXSZZKPHBHMA-IFMPTUIRSA-N
Properties
Complexity:
659  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
6  
Defined Bond Stereocenter Count:
0
Exact Mass:
430.126g/mol
Formal Charge:
0
Heavy Atom Count:
31  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
430.409g/mol
Monoisotopic Mass:
430.126g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
151A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties