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Eugenol rutinoside

CAS No.:
138772-01-7
Catalog Number:
AG009GTX
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG009GTX
Chemical Name:
Eugenol rutinoside
CAS Number:
138772-01-7
MDL Number:
MFCD20275014
IUPAC Name:
(2S,3R,4R,5R,6R)-2-methyl-6-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(2-methoxy-4-prop-2-enylphenoxy)oxan-2-yl]methoxy]oxane-3,4,5-triol
InChI:
InChI=1S/C22H32O11/c1-4-5-11-6-7-12(13(8-11)29-3)32-22-20(28)18(26)16(24)14(33-22)9-30-21-19(27)17(25)15(23)10(2)31-21/h4,6-8,10,14-28H,1,5,9H2,2-3H3/t10-,14+,15-,16+,17+,18-,19+,20+,21+,22+/m0/s1
InChI Key:
KNUPPNGCEAQRSV-XCPHWCDESA-N
Properties
Complexity:
621  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
10  
Defined Bond Stereocenter Count:
0
Exact Mass:
472.194g/mol
Formal Charge:
0
Heavy Atom Count:
33  
Hydrogen Bond Acceptor Count:
11  
Hydrogen Bond Donor Count:
6  
Isotope Atom Count:
0
Molecular Weight:
472.487g/mol
Monoisotopic Mass:
472.194g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
168A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8  
Properties