Name: Name:(S)-Ketoprofen Acyl-β-D-glucuronide
Brand: Angene
SKU: AG009E3T
Rating: 90 (10 reviews)

(S)-Ketoprofen Acyl-β-D-glucuronide

CAS No.:

140148-26-1

Catalog Number:

AG009E3T

Molecular Formula:

Molecular Weight:

Catalog Number:

AG009E3T

Chemical Name:

(S)-Ketoprofen Acyl-β-D-glucuronide

CAS Number:

140148-26-1

MDL Number:

MFCD31562847

IUPAC Name:

(2S,3S,4S,5R,6S)-6-[(2S)-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-/m0/s1

InChI Key:

PBTXSZZKPHBHMA-QVTYPLGRSA-N

Complexity:

659

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

430.126g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

430.409g/mol

Monoisotopic Mass:

430.126g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

151A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7